Benzol und substituierte Derivate

Benzol ist ein aromatisches organisches Molekül, das aus sechs Kohlenstoffatomen und sechs Wasserstoffatomen besteht, die einen Ring bilden. Darunter substituierte derivative Verbindungen.

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p-Anisaldehyd +99 %, Thermo Scientific Chemicals

CAS: 123-11-5 Summenformel: C₈H₈O₂ Molekulargewicht (g/mol): 136.15 MDL-Nummer: MFCD00003385 InChI-Schlüssel: ZRSNZINYAWTAHE-UHFFFAOYSA-N Synonym: p-anisaldehyde,anisaldehyde,anisic aldehyde,p-methoxybenzaldehyde,4-anisaldehyde,aubepine,p-anisic aldehyde,p-formylanisole,benzaldehyde, 4-methoxy,crategine PubChem CID: 31244 ChEBI: CHEBI:28235 IUPAC-Name: 4-Methoxybenzaldehyd SMILES: COC1=CC=C(C=C1)C=O

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InChI-Schlüssel	ZRSNZINYAWTAHE-UHFFFAOYSA-N
IUPAC-Name	4-Methoxybenzaldehyd
PubChem CID	31244
CAS	123-11-5
ChEBI	CHEBI:28235
MDL-Nummer	MFCD00003385
Molekulargewicht (g/mol)	136.15
SMILES	COC1=CC=C(C=C1)C=O
Synonym	p-anisaldehyde,anisaldehyde,anisic aldehyde,p-methoxybenzaldehyde,4-anisaldehyde,aubepine,p-anisic aldehyde,p-formylanisole,benzaldehyde, 4-methoxy,crategine
Summenformel	C₈H₈O₂

Benzylalkohol, 99 %, rein, Thermo Scientific Chemicals

CAS: 100-51-6 Summenformel: C7H8O Molekulargewicht (g/mol): 108.14 MDL-Nummer: MFCD00004599,MFCD03792087 InChI-Schlüssel: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC-Name: Phenylmethanol SMILES: OCC1=CC=CC=C1

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InChI-Schlüssel	WVDDGKGOMKODPV-UHFFFAOYSA-N
IUPAC-Name	Phenylmethanol
PubChem CID	244
CAS	100-51-6
ChEBI	CHEBI:17987
MDL-Nummer	MFCD00004599,MFCD03792087
Molekulargewicht (g/mol)	108.14
SMILES	OCC1=CC=CC=C1
Synonym	benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol
Summenformel	C7H8O

Isoeugenol, Mischung aus cis/trans-Isomeren 99 %, Thermo Scientific Chemicals

CAS: 97-54-1 Summenformel: C10H12O2 Molekulargewicht (g/mol): 164.20 MDL-Nummer: MFCD00009285 InChI-Schlüssel: BJIOGJUNALELMI-ONEGZZNKSA-N Synonym: isoeugenol,e-isoeugenol,trans-isoeugenol,2-methoxy-4-propenylphenol,4-propenylguaiacol,4-hydroxy-3-methoxy-1-propenylbenzene,2-methoxy-4-prop-1-en-1-yl phenol,trans-p-propenylquaiacol,isoeugenol trans-form,4-hydroxy-3-methoxypropenylbenzene PubChem CID: 853433 ChEBI: CHEBI:50545 SMILES: COC1=CC(\C=C\C)=CC=C1O

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InChI-Schlüssel	BJIOGJUNALELMI-ONEGZZNKSA-N
PubChem CID	853433
CAS	97-54-1
ChEBI	CHEBI:50545
MDL-Nummer	MFCD00009285
Molekulargewicht (g/mol)	164.20
SMILES	COC1=CC(\C=C\C)=CC=C1O
Synonym	isoeugenol,e-isoeugenol,trans-isoeugenol,2-methoxy-4-propenylphenol,4-propenylguaiacol,4-hydroxy-3-methoxy-1-propenylbenzene,2-methoxy-4-prop-1-en-1-yl phenol,trans-p-propenylquaiacol,isoeugenol trans-form,4-hydroxy-3-methoxypropenylbenzene
Summenformel	C10H12O2

DAPT, Thermo Scientific Chemicals

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Natriumsalicylat, 99 %, Thermo Scientific Chemicals

CAS: 54-21-7 Summenformel: C7H5NaO3 Molekulargewicht (g/mol): 160.104 MDL-Nummer: MFCD00002440 InChI-Schlüssel: ABBQHOQBGMUPJH-UHFFFAOYSA-M Synonym: sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl PubChem CID: 16760658 ChEBI: CHEBI:9180 IUPAC-Name: Natrium;2-Hydroxybenzoat SMILES: C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]

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InChI-Schlüssel	ABBQHOQBGMUPJH-UHFFFAOYSA-M
IUPAC-Name	Natrium;2-Hydroxybenzoat
PubChem CID	16760658
CAS	54-21-7
ChEBI	CHEBI:9180
MDL-Nummer	MFCD00002440
Molekulargewicht (g/mol)	160.104
SMILES	C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]
Synonym	sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl
Summenformel	C7H5NaO3

Benzoesäure, 99,6 %, ACS-Reagenz

CAS: 65-85-0 Summenformel: C₇H₆O₂ Molekulargewicht (g/mol): 122.12 InChI-Schlüssel: WPYMKLBDIGXBTP-UHFFFAOYSA-N Synonym: benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv PubChem CID: 243 ChEBI: CHEBI:30746 IUPAC-Name: Benzoesäure SMILES: C1=CC=C(C=C1)C(=O)O

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InChI-Schlüssel	WPYMKLBDIGXBTP-UHFFFAOYSA-N
IUPAC-Name	Benzoesäure
PubChem CID	243
CAS	65-85-0
ChEBI	CHEBI:30746
Molekulargewicht (g/mol)	122.12
SMILES	C1=CC=C(C=C1)C(=O)O
Synonym	benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv
Summenformel	C₇H₆O₂

2-Phenoxyethanol, 99 %, Thermo Scientific Chemicals

CAS: 122-99-6 Summenformel: C₈H₁₀O₂ Molekulargewicht (g/mol): 138.17 MDL-Nummer: MFCD00002857 InChI-Schlüssel: QCDWFXQBSFUVSP-UHFFFAOYSA-N Synonym: phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane PubChem CID: 31236 ChEBI: CHEBI:64275 IUPAC-Name: 2-Phenoxyethanol SMILES: C1=CC=C(C=C1)OCCO

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InChI-Schlüssel	QCDWFXQBSFUVSP-UHFFFAOYSA-N
IUPAC-Name	2-Phenoxyethanol
PubChem CID	31236
CAS	122-99-6
ChEBI	CHEBI:64275
MDL-Nummer	MFCD00002857
Molekulargewicht (g/mol)	138.17
SMILES	C1=CC=C(C=C1)OCCO
Synonym	phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane
Summenformel	C₈H₁₀O₂

Thermo Scientific Chemicals Basisches Fuchsin

CAS: 632-99-5 Summenformel: C20H20ClN3 Molekulargewicht (g/mol): 337.85 MDL-Nummer: MFCD00012569 InChI-Schlüssel: AXDJCCTWPBKUKL-UHFFFAOYSA-N Synonym: basic violet 14,fuchsin,fuchsin basic,magenta,rosaniline,fuchsine,basic fuchsine,basic magenta,rose aniline,fuchsin, basic PubChem CID: 12447 IUPAC-Name: hydrogen 4-[(4-aminophenyl)(4-imino-3-methylcyclohexa-2,5-dien-1-ylidene)methyl]aniline chloride SMILES: [H+].[Cl-].CC1=CC(C=CC1=N)=C(C1=CC=C(N)C=C1)C1=CC=C(N)C=C1

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InChI-Schlüssel	AXDJCCTWPBKUKL-UHFFFAOYSA-N
IUPAC-Name	hydrogen 4-[(4-aminophenyl)(4-imino-3-methylcyclohexa-2,5-dien-1-ylidene)methyl]aniline chloride
PubChem CID	12447
CAS	632-99-5
MDL-Nummer	MFCD00012569
Molekulargewicht (g/mol)	337.85
SMILES	[H+].[Cl-].CC1=CC(C=CC1=N)=C(C1=CC=C(N)C=C1)C1=CC=C(N)C=C1
Synonym	basic violet 14,fuchsin,fuchsin basic,magenta,rosaniline,fuchsine,basic fuchsine,basic magenta,rose aniline,fuchsin, basic
Summenformel	C20H20ClN3

1,3,5-Trimethoxybenzol, 99 %, Thermo Scientific Chemicals

CAS: 621-23-8 Summenformel: C9H12O3 Molekulargewicht (g/mol): 168.19 MDL-Nummer: MFCD00008385 InChI-Schlüssel: LKUDPHPHKOZXCD-UHFFFAOYSA-N Synonym: phloroglucinol trimethyl ether,sym-trimethoxybenzene,benzene, 1,3,5-trimethoxy,1,3,5-trimethyoxybenzene,unii-00vji3vg3d,1,3,5-trimethoxy benzene,o,o,o-1,3,5-trimethylresorcinol,00vji3vg3d,dsstox_cid_25963,dsstox_rid_81259 PubChem CID: 69301 ChEBI: CHEBI:31038 IUPAC-Name: 1,3,5-Trimethoxybenzol SMILES: COC1=CC(OC)=CC(OC)=C1

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InChI-Schlüssel	LKUDPHPHKOZXCD-UHFFFAOYSA-N
IUPAC-Name	1,3,5-Trimethoxybenzol
PubChem CID	69301
CAS	621-23-8
ChEBI	CHEBI:31038
MDL-Nummer	MFCD00008385
Molekulargewicht (g/mol)	168.19
SMILES	COC1=CC(OC)=CC(OC)=C1
Synonym	phloroglucinol trimethyl ether,sym-trimethoxybenzene,benzene, 1,3,5-trimethoxy,1,3,5-trimethyoxybenzene,unii-00vji3vg3d,1,3,5-trimethoxy benzene,o,o,o-1,3,5-trimethylresorcinol,00vji3vg3d,dsstox_cid_25963,dsstox_rid_81259
Summenformel	C9H12O3

4-Dimethylaminobenzaldehyd, 99+ %, Thermo Scientific Chemicals

CAS: 100-10-7 Summenformel: C9H11NO Molekulargewicht (g/mol): 149.19 MDL-Nummer: MFCD00003381 InChI-Schlüssel: BGNGWHSBYQYVRX-UHFFFAOYSA-N Synonym: 4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal PubChem CID: 7479 IUPAC-Name: 4-(dimethylamino)benzaldehyde SMILES: CN(C)C1=CC=C(C=O)C=C1

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InChI-Schlüssel	BGNGWHSBYQYVRX-UHFFFAOYSA-N
IUPAC-Name	4-(dimethylamino)benzaldehyde
PubChem CID	7479
CAS	100-10-7
MDL-Nummer	MFCD00003381
Molekulargewicht (g/mol)	149.19
SMILES	CN(C)C1=CC=C(C=O)C=C1
Synonym	4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal
Summenformel	C9H11NO

Veratrol +99 %, Thermo Scientific Chemicals

CAS: 91-16-7 Summenformel: C₈H₁₀O₂ Molekulargewicht (g/mol): 138.17 MDL-Nummer: MFCD00008357 InChI-Schlüssel: ABDKAPXRBAPSQN-UHFFFAOYSA-N Synonym: veratrole,veratrol,pyrocatechol dimethyl ether,o-dimethoxybenzene,catechol dimethyl ether,benzene, 1,2-dimethoxy,2-methoxyanisole,o,o-dimethyl catechol,2-dimethoxybenzol,benzene, o-dimethoxy PubChem CID: 7043 ChEBI: CHEBI:59114 IUPAC-Name: 1,2-Dimethoxybenzol SMILES: COC1=CC=CC=C1OC

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InChI-Schlüssel	ABDKAPXRBAPSQN-UHFFFAOYSA-N
IUPAC-Name	1,2-Dimethoxybenzol
PubChem CID	7043
CAS	91-16-7
ChEBI	CHEBI:59114
MDL-Nummer	MFCD00008357
Molekulargewicht (g/mol)	138.17
SMILES	COC1=CC=CC=C1OC
Synonym	veratrole,veratrol,pyrocatechol dimethyl ether,o-dimethoxybenzene,catechol dimethyl ether,benzene, 1,2-dimethoxy,2-methoxyanisole,o,o-dimethyl catechol,2-dimethoxybenzol,benzene, o-dimethoxy
Summenformel	C₈H₁₀O₂

4-Methoxybenzaldehyd, 98 %, Thermo Scientific Chemicals

CAS: 123-11-5 Summenformel: C8H8O2 Molekulargewicht (g/mol): 136.15 MDL-Nummer: MFCD00003385 InChI-Schlüssel: ZRSNZINYAWTAHE-UHFFFAOYSA-N Synonym: p-anisaldehyde,anisaldehyde,anisic aldehyde,p-methoxybenzaldehyde,4-anisaldehyde,aubepine,p-anisic aldehyde,p-formylanisole,benzaldehyde, 4-methoxy,crategine PubChem CID: 31244 ChEBI: CHEBI:28235 IUPAC-Name: 4-Methoxybenzaldehyd SMILES: COC1=CC=C(C=C1)C=O

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InChI-Schlüssel	ZRSNZINYAWTAHE-UHFFFAOYSA-N
IUPAC-Name	4-Methoxybenzaldehyd
PubChem CID	31244
CAS	123-11-5
ChEBI	CHEBI:28235
MDL-Nummer	MFCD00003385
Molekulargewicht (g/mol)	136.15
SMILES	COC1=CC=C(C=C1)C=O
Synonym	p-anisaldehyde,anisaldehyde,anisic aldehyde,p-methoxybenzaldehyde,4-anisaldehyde,aubepine,p-anisic aldehyde,p-formylanisole,benzaldehyde, 4-methoxy,crategine
Summenformel	C8H8O2

Methylendi-p-phenyl diisocyanat, 98 %, Flocken, Thermo Scientific Chemicals

CAS: 101-68-8 Summenformel: C₁₅H₁₀N₂O₂ Molekulargewicht (g/mol): 250.26 MDL-Nummer: MFCD00036131 InChI-Schlüssel: UPMLOUAZCHDJJD-UHFFFAOYSA-N Synonym: 4,4'-diphenylmethane diisocyanate,diphenylmethane diisocyanate,isonate,4,4'-diisocyanatodiphenylmethane,p,p'-diphenylmethane diisocyanate,bis 4-isocyanatophenyl methane,4,4'-methylenebis phenyl isocyanate,methylbisphenyl isocyanate,1,1'-methylenebis 4-isocyanatobenzene,methylene diphenyl diisocyanate PubChem CID: 7570 ChEBI: CHEBI:53218 IUPAC-Name: 1-Isocyanat-4-[(4-isocyanatphenyl)methyl]Benzol SMILES: C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O

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InChI-Schlüssel	UPMLOUAZCHDJJD-UHFFFAOYSA-N
IUPAC-Name	1-Isocyanat-4-[(4-isocyanatphenyl)methyl]Benzol
PubChem CID	7570
CAS	101-68-8
ChEBI	CHEBI:53218
MDL-Nummer	MFCD00036131
Molekulargewicht (g/mol)	250.26
SMILES	C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O
Synonym	4,4'-diphenylmethane diisocyanate,diphenylmethane diisocyanate,isonate,4,4'-diisocyanatodiphenylmethane,p,p'-diphenylmethane diisocyanate,bis 4-isocyanatophenyl methane,4,4'-methylenebis phenyl isocyanate,methylbisphenyl isocyanate,1,1'-methylenebis 4-isocyanatobenzene,methylene diphenyl diisocyanate
Summenformel	C₁₅H₁₀N₂O₂

Methyl 4-Hydroxybenzoat 99 %, Thermo Scientific Chemicals

CAS: 99-76-3 Summenformel: C8H8O3 Molekulargewicht (g/mol): 152.149 MDL-Nummer: MFCD00002352 InChI-Schlüssel: LXCFILQKKLGQFO-UHFFFAOYSA-N Synonym: methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m PubChem CID: 7456 ChEBI: CHEBI:31835 IUPAC-Name: Methyl 4-Hydroxybenzoat SMILES: COC(=O)C1=CC=C(C=C1)O

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InChI-Schlüssel	LXCFILQKKLGQFO-UHFFFAOYSA-N
IUPAC-Name	Methyl 4-Hydroxybenzoat
PubChem CID	7456
CAS	99-76-3
ChEBI	CHEBI:31835
MDL-Nummer	MFCD00002352
Molekulargewicht (g/mol)	152.149
SMILES	COC(=O)C1=CC=C(C=C1)O
Synonym	methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m
Summenformel	C8H8O3

Benzophenon, 99 %, rein, Thermo Scientific Chemicals

CAS: 119-61-9 Summenformel: C₁₃H₁₀O Molekulargewicht (g/mol): 182.22 InChI-Schlüssel: RWCCWEUUXYIKHB-UHFFFAOYSA-N Synonym: benzophenone,diphenyl ketone,benzoylbenzene,phenyl ketone,methanone, diphenyl,alpha-oxoditane,ketone, diphenyl,benzene, benzoyl,alpha-oxodiphenylmethane,diphenylketone PubChem CID: 3102 ChEBI: CHEBI:41308 IUPAC-Name: Diphenylmethanon SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC=C2

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InChI-Schlüssel	RWCCWEUUXYIKHB-UHFFFAOYSA-N
IUPAC-Name	Diphenylmethanon
PubChem CID	3102
CAS	119-61-9
ChEBI	CHEBI:41308
Molekulargewicht (g/mol)	182.22
SMILES	C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
Synonym	benzophenone,diphenyl ketone,benzoylbenzene,phenyl ketone,methanone, diphenyl,alpha-oxoditane,ketone, diphenyl,benzene, benzoyl,alpha-oxodiphenylmethane,diphenylketone
Summenformel	C₁₃H₁₀O

Benzol und substituierte Derivate

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