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Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.
Benzene and substituted derivatives (67,618)
Phenols (13,422)
Naphthalenes (5,064)
Fluorenes (1,235)
Unsubstituted Phenols (1,165)
Thiophenols (617)
Phenol esters (559)
Anthracenes (413)
Phenanthrenes and derivatives (327)
Tetralins (327)
Indanes (313)
Triphenyl compounds (277)
Pyrenes (229)
Dibenzocycloheptenes (62)
Naphthacenes (36)
Ellagic acids and derivatives (33)
Pentacenes (19)
Pentacenequinones (16)
Acenaphthylenes (15)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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1,846 – 1,860 of 78,434 results
1,846

4-(4-Hydroxy-3-methoxyphenyl)-2-butanone, 97%

CAS: 122-48-5 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00048232 InChI Key: OJYLAHXKWMRDGS-UHFFFAOYSA-N Synonym: zingerone,vanillylacetone,zingiberone,4-4-hydroxy-3-methoxyphenyl butan-2-one,zingherone,4-4-hydroxy-3-methoxyphenyl-2-butanone,gingerone,vanillyl acetone,0-paradol,2-butanone, 4-4-hydroxy-3-methoxyphenyl PubChem CID: 31211 ChEBI: CHEBI:68657 IUPAC Name: 4-(4-hydroxy-3-methoxyphenyl)butan-2-one SMILES: CC(=O)CCC1=CC(=C(C=C1)O)OC

PubChem CID 31211
CAS 122-48-5
Molecular Weight (g/mol) 194.23
ChEBI CHEBI:68657
MDL Number MFCD00048232
SMILES CC(=O)CCC1=CC(=C(C=C1)O)OC
Synonym zingerone,vanillylacetone,zingiberone,4-4-hydroxy-3-methoxyphenyl butan-2-one,zingherone,4-4-hydroxy-3-methoxyphenyl-2-butanone,gingerone,vanillyl acetone,0-paradol,2-butanone, 4-4-hydroxy-3-methoxyphenyl
IUPAC Name 4-(4-hydroxy-3-methoxyphenyl)butan-2-one
InChI Key OJYLAHXKWMRDGS-UHFFFAOYSA-N
Molecular Formula C11H14O3
1,847

Methyl 4-fluoro-3-hydroxybenzoate, 98+%

CAS: 214822-96-5 Molecular Formula: C8H7FO3 Molecular Weight (g/mol): 170.139 MDL Number: MFCD06797457 InChI Key: CUGWNEOTLGLGDG-UHFFFAOYSA-N Synonym: 4-fluoro-3-hydroxybenzoic acid methyl ester,benzoic acid, 4-fluoro-3-hydroxy-, methyl ester,pubchem3567,acmc-209fky,methyl4-fluoro-3-hydroxybenzoate,methyl 4-fluoranyl-3-oxidanyl-benzoate,3-hydroxy-4-fluorobenzoic acid methyl ester,4-fluoro-3-hydroxy-benzoic acid methyl ester,benzoic acid,4-fluoro-3-hydroxy-, methyl ester PubChem CID: 12016892 IUPAC Name: methyl 4-fluoro-3-hydroxybenzoate SMILES: COC(=O)C1=CC(=C(C=C1)F)O

PubChem CID 12016892
CAS 214822-96-5
Molecular Weight (g/mol) 170.139
MDL Number MFCD06797457
SMILES COC(=O)C1=CC(=C(C=C1)F)O
Synonym 4-fluoro-3-hydroxybenzoic acid methyl ester,benzoic acid, 4-fluoro-3-hydroxy-, methyl ester,pubchem3567,acmc-209fky,methyl4-fluoro-3-hydroxybenzoate,methyl 4-fluoranyl-3-oxidanyl-benzoate,3-hydroxy-4-fluorobenzoic acid methyl ester,4-fluoro-3-hydroxy-benzoic acid methyl ester,benzoic acid,4-fluoro-3-hydroxy-, methyl ester
IUPAC Name methyl 4-fluoro-3-hydroxybenzoate
InChI Key CUGWNEOTLGLGDG-UHFFFAOYSA-N
Molecular Formula C8H7FO3
1,848

8-Amino-2-naphthol, 98%

CAS: 118-46-7 Molecular Formula: C10H9NO Molecular Weight (g/mol): 159.19 MDL Number: MFCD00004031 InChI Key: KVHHMYZBFBSVDI-UHFFFAOYSA-N Synonym: 1-amino-7-naphthol,8-amino-2-naphthol,2-naphthalenol, 8-amino,1-amino-7-hydroxynaphthalene,7-hydroxy-1-naphthylamine,2-naphthol, 8-amino,8-amino-2-naphtol,8-aminonaphth-2-ol,1-amino-7-naphthol;,8-amino-2-naphthaleno PubChem CID: 8358 IUPAC Name: 8-aminonaphthalen-2-ol SMILES: NC1=C2C=C(O)C=CC2=CC=C1

PubChem CID 8358
CAS 118-46-7
Molecular Weight (g/mol) 159.19
MDL Number MFCD00004031
SMILES NC1=C2C=C(O)C=CC2=CC=C1
Synonym 1-amino-7-naphthol,8-amino-2-naphthol,2-naphthalenol, 8-amino,1-amino-7-hydroxynaphthalene,7-hydroxy-1-naphthylamine,2-naphthol, 8-amino,8-amino-2-naphtol,8-aminonaphth-2-ol,1-amino-7-naphthol;,8-amino-2-naphthaleno
IUPAC Name 8-aminonaphthalen-2-ol
InChI Key KVHHMYZBFBSVDI-UHFFFAOYSA-N
Molecular Formula C10H9NO
1,849

2-Formylphenylboronic acid pinacol ester, 97%

CAS: 380151-85-9 Molecular Formula: C13H17BO3 Molecular Weight (g/mol): 232.09 MDL Number: MFCD07363841 InChI Key: SLJMPQLPRHIAOM-UHFFFAOYSA-N Synonym: 2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,2-formylphenylboronic acid pinacol ester,2-formylphenyl boronic acid pinacol ester,2-formylphenylboronic acid, pinacol ester,2-formylbenzeneboronic acid pinacol ester,2-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,2-2-formylphenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-benzaldehyde,amtb063,2-boronobenzaldehyde, pinacol ester PubChem CID: 10977322 IUPAC Name: 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde SMILES: CC1(C)OB(OC1(C)C)C1=CC=CC=C1C=O

PubChem CID 10977322
CAS 380151-85-9
Molecular Weight (g/mol) 232.09
MDL Number MFCD07363841
SMILES CC1(C)OB(OC1(C)C)C1=CC=CC=C1C=O
Synonym 2-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,2-formylphenylboronic acid pinacol ester,2-formylphenyl boronic acid pinacol ester,2-formylphenylboronic acid, pinacol ester,2-formylbenzeneboronic acid pinacol ester,2-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,2-2-formylphenyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane,2-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl-benzaldehyde,amtb063,2-boronobenzaldehyde, pinacol ester
IUPAC Name 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
InChI Key SLJMPQLPRHIAOM-UHFFFAOYSA-N
Molecular Formula C13H17BO3
1,850

3-Amino-2,4,6-triiodobenzoic acid, 99% (dry wt.), water <4%

CAS: 3119-15-1 Molecular Formula: C7H3I3NNaO2 Molecular Weight (g/mol): 536.81 MDL Number: MFCD00007681 InChI Key: CTXRMWPLTDAHOR-UHFFFAOYSA-M Synonym: unii-99h77d8mtd,3-amino-2,4,6-triiodo-benzoic acid,acido 3-amino-2,4,6-triiodobenzoico italian,benzoic acid, 3-amino-2,4,6-triiodo,3-amino-2,4,6-triiodo-benzoicacid,acido 3-amino-2,4,6-triiodobenzoico,pubchem4987,acmc-1co9w,4-14-00-01118 beilstein handbook reference,2,4,6-triiodo-3-aminobenzoic acid PubChem CID: 18387 IUPAC Name: 3-amino-2,4,6-triiodobenzoic acid SMILES: [Na+].NC1=C(I)C=C(I)C(C([O-])=O)=C1I

PubChem CID 18387
CAS 3119-15-1
Molecular Weight (g/mol) 536.81
MDL Number MFCD00007681
SMILES [Na+].NC1=C(I)C=C(I)C(C([O-])=O)=C1I
Synonym unii-99h77d8mtd,3-amino-2,4,6-triiodo-benzoic acid,acido 3-amino-2,4,6-triiodobenzoico italian,benzoic acid, 3-amino-2,4,6-triiodo,3-amino-2,4,6-triiodo-benzoicacid,acido 3-amino-2,4,6-triiodobenzoico,pubchem4987,acmc-1co9w,4-14-00-01118 beilstein handbook reference,2,4,6-triiodo-3-aminobenzoic acid
IUPAC Name 3-amino-2,4,6-triiodobenzoic acid
InChI Key CTXRMWPLTDAHOR-UHFFFAOYSA-M
Molecular Formula C7H3I3NNaO2
1,851

Di-n-propyl phthalate, 98%

CAS: 131-16-8 Molecular Formula: C14H18O4 Molecular Weight (g/mol): 250.294 MDL Number: MFCD00009371 InChI Key: MQHNKCZKNAJROC-UHFFFAOYSA-N Synonym: dipropyl phthalate,di-n-propyl phthalate,di-n-propylphthalate,phthalic acid dipropyl ester,phthalic acid, dipropyl ester,phthalic acid di-n-propyl ester,1,2-benzenedicarboxylic acid, dipropyl ester,dipropylphthalate,n-dipropyl phthalate,unii-8usp5y77ss PubChem CID: 8559 ChEBI: CHEBI:60069 IUPAC Name: dipropyl benzene-1,2-dicarboxylate SMILES: CCCOC(=O)C1=CC=CC=C1C(=O)OCCC

PubChem CID 8559
CAS 131-16-8
Molecular Weight (g/mol) 250.294
ChEBI CHEBI:60069
MDL Number MFCD00009371
SMILES CCCOC(=O)C1=CC=CC=C1C(=O)OCCC
Synonym dipropyl phthalate,di-n-propyl phthalate,di-n-propylphthalate,phthalic acid dipropyl ester,phthalic acid, dipropyl ester,phthalic acid di-n-propyl ester,1,2-benzenedicarboxylic acid, dipropyl ester,dipropylphthalate,n-dipropyl phthalate,unii-8usp5y77ss
IUPAC Name dipropyl benzene-1,2-dicarboxylate
InChI Key MQHNKCZKNAJROC-UHFFFAOYSA-N
Molecular Formula C14H18O4
1,852

[1-(Phenylsulfonyl)-1H-indol-2-yl]methanol, ≥97%, Thermo Scientific™

CAS: 73282-11-8 Molecular Formula: C15H13NO3S Molecular Weight (g/mol): 287.33 MDL Number: MFCD03086093 InChI Key: LRYLVFIUTJMZBY-UHFFFAOYSA-N Synonym: 1-phenylsulfonyl-1h-indol-2-yl methanol,1-benzenesulfonyl indol-2-yl methanol,1-phenylsulfonyl-1h-indole-2-methanol,1h-indole-2-methanol,1-phenylsulfonyl,1-benzenesulfonyl-1h-indol-2-yl methanol PubChem CID: 2776227 SMILES: OCC1=CC2=CC=CC=C2N1S(=O)(=O)C1=CC=CC=C1

PubChem CID 2776227
CAS 73282-11-8
Molecular Weight (g/mol) 287.33
MDL Number MFCD03086093
SMILES OCC1=CC2=CC=CC=C2N1S(=O)(=O)C1=CC=CC=C1
Synonym 1-phenylsulfonyl-1h-indol-2-yl methanol,1-benzenesulfonyl indol-2-yl methanol,1-phenylsulfonyl-1h-indole-2-methanol,1h-indole-2-methanol,1-phenylsulfonyl,1-benzenesulfonyl-1h-indol-2-yl methanol
InChI Key LRYLVFIUTJMZBY-UHFFFAOYSA-N
Molecular Formula C15H13NO3S
1,853

2,3-Dichlorophenol, 98+%

CAS: 576-24-9 Molecular Formula: C6H4Cl2O Molecular Weight (g/mol): 163.00 MDL Number: MFCD00002160 InChI Key: UMPSXRYVXUPCOS-UHFFFAOYSA-N Synonym: phenol, 2,3-dichloro,dichlorophenol,unii-izm39u444l,ccris 5902,2,3-dichloro phenol,2,3 dichlorophenol,phenol,3-dichloro,pubchem3696,2,3-dichloro-phenol,acmc-1ar0l PubChem CID: 11334 IUPAC Name: 2,3-dichlorophenol SMILES: OC1=CC=CC(Cl)=C1Cl

PubChem CID 11334
CAS 576-24-9
Molecular Weight (g/mol) 163.00
MDL Number MFCD00002160
SMILES OC1=CC=CC(Cl)=C1Cl
Synonym phenol, 2,3-dichloro,dichlorophenol,unii-izm39u444l,ccris 5902,2,3-dichloro phenol,2,3 dichlorophenol,phenol,3-dichloro,pubchem3696,2,3-dichloro-phenol,acmc-1ar0l
IUPAC Name 2,3-dichlorophenol
InChI Key UMPSXRYVXUPCOS-UHFFFAOYSA-N
Molecular Formula C6H4Cl2O
1,854

2-Amino-5-methylphenol, 98%

CAS: 2835-98-5 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.155 MDL Number: MFCD00007693 InChI Key: HCPJEHJGFKWRFM-UHFFFAOYSA-N Synonym: 6-amino-m-cresol,2-hydroxy-4-methylaniline,phenol, 2-amino-5-methyl,4-amino-3-hydroxytoluene,2-hydroxy-p-toluidine,unii-qcg4es2a26,6-amino-3-cresol,3-methyl-6-aminophenol,6-amino-3-methylphenol,qcg4es2a26 PubChem CID: 76082 IUPAC Name: 2-amino-5-methylphenol SMILES: CC1=CC(=C(C=C1)N)O

PubChem CID 76082
CAS 2835-98-5
Molecular Weight (g/mol) 123.155
MDL Number MFCD00007693
SMILES CC1=CC(=C(C=C1)N)O
Synonym 6-amino-m-cresol,2-hydroxy-4-methylaniline,phenol, 2-amino-5-methyl,4-amino-3-hydroxytoluene,2-hydroxy-p-toluidine,unii-qcg4es2a26,6-amino-3-cresol,3-methyl-6-aminophenol,6-amino-3-methylphenol,qcg4es2a26
IUPAC Name 2-amino-5-methylphenol
InChI Key HCPJEHJGFKWRFM-UHFFFAOYSA-N
Molecular Formula C7H9NO
1,855

4-(Methylthio)phenol, 98%

CAS: 1073-72-9 Molecular Formula: C7H8OS Molecular Weight (g/mol): 140.20 MDL Number: MFCD00002351 InChI Key: QASBCTGZKABPKX-UHFFFAOYSA-N Synonym: 4-methylthio phenol,4-methylmercapto phenol,phenol, 4-methylthio,p-methylthio phenol,4-hydroxythioanisole,4-methylmercaptophenol,p-hydroxythioanisole,4-methylsulfanyl phenol,phenol, p-methylthio,p-hydroxyphenyl methyl sulfide PubChem CID: 14086 ChEBI: CHEBI:38862 IUPAC Name: 4-methylsulfanylphenol SMILES: CSC1=CC=C(O)C=C1

PubChem CID 14086
CAS 1073-72-9
Molecular Weight (g/mol) 140.20
ChEBI CHEBI:38862
MDL Number MFCD00002351
SMILES CSC1=CC=C(O)C=C1
Synonym 4-methylthio phenol,4-methylmercapto phenol,phenol, 4-methylthio,p-methylthio phenol,4-hydroxythioanisole,4-methylmercaptophenol,p-hydroxythioanisole,4-methylsulfanyl phenol,phenol, p-methylthio,p-hydroxyphenyl methyl sulfide
IUPAC Name 4-methylsulfanylphenol
InChI Key QASBCTGZKABPKX-UHFFFAOYSA-N
Molecular Formula C7H8OS
1,856

3,6-Difluorophthalic acid, 98%, Thermo Scientific Chemicals

CAS: 651-97-8 Molecular Formula: C8H4F2O4 Molecular Weight (g/mol): 202.113 MDL Number: MFCD03840499 InChI Key: VFLMWMTWWZGXGA-UHFFFAOYSA-N Synonym: 3,6-difluorobenzene-1,2-dicarboxylic acid,1,4-difluorophthalic acid,3,6-difluorophthalicacid,pubchem1945,acmc-1ays1,3,6-difluoro-phthalic acid,ksc352e6d,3,5-difluoro-1,2-benzenedicarboxylic acid,1,2-benzenedicarboxylicacid, 3,6-difluoro PubChem CID: 643385 IUPAC Name: 3,6-difluorophthalic acid SMILES: C1=CC(=C(C(=C1F)C(=O)O)C(=O)O)F

PubChem CID 643385
CAS 651-97-8
Molecular Weight (g/mol) 202.113
MDL Number MFCD03840499
SMILES C1=CC(=C(C(=C1F)C(=O)O)C(=O)O)F
Synonym 3,6-difluorobenzene-1,2-dicarboxylic acid,1,4-difluorophthalic acid,3,6-difluorophthalicacid,pubchem1945,acmc-1ays1,3,6-difluoro-phthalic acid,ksc352e6d,3,5-difluoro-1,2-benzenedicarboxylic acid,1,2-benzenedicarboxylicacid, 3,6-difluoro
IUPAC Name 3,6-difluorophthalic acid
InChI Key VFLMWMTWWZGXGA-UHFFFAOYSA-N
Molecular Formula C8H4F2O4
1,857

2,3,5,6-Tetrafluoroanisole, 97%

CAS: 2324-98-3 Molecular Formula: C7H4F4O Molecular Weight (g/mol): 180.10 MDL Number: MFCD00000311 InChI Key: AXCOCGJDERQVDK-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluoroanisole,2,3,5,6-tetrafluoromethoxy benzene,anisole, 2,3,5,6-tetrafluoro,2,3,5,6-tetrafluoromethoxybenzene,methyl 2,3,5,6-tetrafluorophenyl ether,benzene, 1,2,4,5-tetrafluoro-3-methoxy,1,2,4,5-tetrafluoro-3-methoxy-benzene,pubchem10114,acmc-1clho,2,3,5,6-tetrafluoro-anisole PubChem CID: 75351 IUPAC Name: 1,2,4,5-tetrafluoro-3-methoxybenzene SMILES: COC1=C(F)C(F)=CC(F)=C1F

PubChem CID 75351
CAS 2324-98-3
Molecular Weight (g/mol) 180.10
MDL Number MFCD00000311
SMILES COC1=C(F)C(F)=CC(F)=C1F
Synonym 2,3,5,6-tetrafluoroanisole,2,3,5,6-tetrafluoromethoxy benzene,anisole, 2,3,5,6-tetrafluoro,2,3,5,6-tetrafluoromethoxybenzene,methyl 2,3,5,6-tetrafluorophenyl ether,benzene, 1,2,4,5-tetrafluoro-3-methoxy,1,2,4,5-tetrafluoro-3-methoxy-benzene,pubchem10114,acmc-1clho,2,3,5,6-tetrafluoro-anisole
IUPAC Name 1,2,4,5-tetrafluoro-3-methoxybenzene
InChI Key AXCOCGJDERQVDK-UHFFFAOYSA-N
Molecular Formula C7H4F4O
1,858

2,4-Dimethoxybenzonitrile, 99%

CAS: 4107-65-7 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.176 MDL Number: MFCD00001786 InChI Key: RYRZSQQELLQCMZ-UHFFFAOYSA-N Synonym: benzonitrile, 2,4-dimethoxy,2,4-dimethoxy-benzonitrile,2,4-dimethoxybenzenecarbonitrile,pubchem13105,acmc-1anqc,2.4-dimethoxybenzonitril,ksc497m9f,2,4-dimethoxybenzonitrile PubChem CID: 77750 IUPAC Name: 2,4-dimethoxybenzonitrile SMILES: COC1=CC(=C(C=C1)C#N)OC

PubChem CID 77750
CAS 4107-65-7
Molecular Weight (g/mol) 163.176
MDL Number MFCD00001786
SMILES COC1=CC(=C(C=C1)C#N)OC
Synonym benzonitrile, 2,4-dimethoxy,2,4-dimethoxy-benzonitrile,2,4-dimethoxybenzenecarbonitrile,pubchem13105,acmc-1anqc,2.4-dimethoxybenzonitril,ksc497m9f,2,4-dimethoxybenzonitrile
IUPAC Name 2,4-dimethoxybenzonitrile
InChI Key RYRZSQQELLQCMZ-UHFFFAOYSA-N
Molecular Formula C9H9NO2
1,859

p-Thiocresol, 98%

CAS: 106-45-6 Molecular Formula: C7H8S Molecular Weight (g/mol): 124.201 MDL Number: MFCD00004851 InChI Key: WLHCBQAPPJAULW-UHFFFAOYSA-N Synonym: p-toluenethiol,p-thiocresol,4-thiocresol,4-methylthiophenol,p-methylthiophenol,benzenethiol, 4-methyl,4-toluenethiol,p-tolyl mercaptan,p-thiolcresol,p-tolylthiol PubChem CID: 7811 IUPAC Name: 4-methylbenzenethiol SMILES: CC1=CC=C(C=C1)S

PubChem CID 7811
CAS 106-45-6
Molecular Weight (g/mol) 124.201
MDL Number MFCD00004851
SMILES CC1=CC=C(C=C1)S
Synonym p-toluenethiol,p-thiocresol,4-thiocresol,4-methylthiophenol,p-methylthiophenol,benzenethiol, 4-methyl,4-toluenethiol,p-tolyl mercaptan,p-thiolcresol,p-tolylthiol
IUPAC Name 4-methylbenzenethiol
InChI Key WLHCBQAPPJAULW-UHFFFAOYSA-N
Molecular Formula C7H8S
1,860

3-Bromostyrene, 97%, stab. with 0.1% 4-tert-butylcatechol

CAS: 2039-86-3 Molecular Formula: C8H7Br Molecular Weight (g/mol): 183.048 MDL Number: MFCD00000088 InChI Key: KQJQPCJDKBKSLV-UHFFFAOYSA-N Synonym: 3-bromostyrene,1-bromo-3-vinylbenzene,m-bromostyrene,benzene, 1-bromo-3-ethenyl,1-bromo-3-vinyl-benzene,unii-6xe3sf241y,3-bromo-styrene,pubchem23859,acmc-1cmdc,1-bromo-3-vinylbenzene # PubChem CID: 74870 IUPAC Name: 1-bromo-3-ethenylbenzene SMILES: C=CC1=CC(=CC=C1)Br

PubChem CID 74870
CAS 2039-86-3
Molecular Weight (g/mol) 183.048
MDL Number MFCD00000088
SMILES C=CC1=CC(=CC=C1)Br
Synonym 3-bromostyrene,1-bromo-3-vinylbenzene,m-bromostyrene,benzene, 1-bromo-3-ethenyl,1-bromo-3-vinyl-benzene,unii-6xe3sf241y,3-bromo-styrene,pubchem23859,acmc-1cmdc,1-bromo-3-vinylbenzene #
IUPAC Name 1-bromo-3-ethenylbenzene
InChI Key KQJQPCJDKBKSLV-UHFFFAOYSA-N
Molecular Formula C8H7Br