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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 (67,941)
Phenols (13,626)
Naphthalenes (5,098)
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Unsubstituted Phenols (1,166)
Thiophenols (617)
Phenol esters (564)
Anthracenes (419)
Phenanthrenes and derivatives (332)
Tetralins (327)
Indanes (313)
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Ellagic acids and derivatives (33)
Pentacenes (19)
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1-hydroxylamino 2-unsubstituted benzenoids (6)

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3,766 – 3,780 of 79,013 results
3,766

4-(3-Thienyl)benzoic acid, 97%, Thermo Scientific™

CAS: 29886-64-4 Molecular Formula: C11H8O2S Molecular Weight (g/mol): 204.243 MDL Number: MFCD03783559 InChI Key: FISAUHGRILVMDP-UHFFFAOYSA-N Synonym: 4-3-thienyl benzoic acid,4-thiophen-3-yl benzoic acid,4-thiophen-3-yl-benzoic acid,benzoic acid, 4-3-thienyl,4-thien-3-ylbenzoic acid,4-3-thienyl-benzoic acid,maybridge3_004545,acmc-1cisg PubChem CID: 736862 IUPAC Name: 4-thiophen-3-ylbenzoic acid SMILES: C1=CC(=CC=C1C2=CSC=C2)C(=O)O

PubChem CID 736862
CAS 29886-64-4
Molecular Weight (g/mol) 204.243
MDL Number MFCD03783559
SMILES C1=CC(=CC=C1C2=CSC=C2)C(=O)O
Synonym 4-3-thienyl benzoic acid,4-thiophen-3-yl benzoic acid,4-thiophen-3-yl-benzoic acid,benzoic acid, 4-3-thienyl,4-thien-3-ylbenzoic acid,4-3-thienyl-benzoic acid,maybridge3_004545,acmc-1cisg
IUPAC Name 4-thiophen-3-ylbenzoic acid
InChI Key FISAUHGRILVMDP-UHFFFAOYSA-N
Molecular Formula C11H8O2S
3,767

3-Fluoro-4-methoxybenzaldehyde, 98%

CAS: 351-54-2 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00003349 InChI Key: SOQCZBSZZLWDGU-UHFFFAOYSA-N Synonym: 3-fluoro-p-anisaldehyde,3-fluoro-4-methoxy-benzaldehyde,3-fluoro-4-anisaldehyde,benzaldehyde, 3-fluoro-4-methoxy,3-fluoro-4-methoxy benzaldehyde,3-fluoroanisaldehyde,3-fluoro-anisaldehyde,pubchem1448,acmc-209idn,2-fluoro-4-formylanisole PubChem CID: 67696 IUPAC Name: 3-fluoro-4-methoxybenzaldehyde SMILES: COC1=C(C=C(C=C1)C=O)F

PubChem CID 67696
CAS 351-54-2
Molecular Weight (g/mol) 154.14
MDL Number MFCD00003349
SMILES COC1=C(C=C(C=C1)C=O)F
Synonym 3-fluoro-p-anisaldehyde,3-fluoro-4-methoxy-benzaldehyde,3-fluoro-4-anisaldehyde,benzaldehyde, 3-fluoro-4-methoxy,3-fluoro-4-methoxy benzaldehyde,3-fluoroanisaldehyde,3-fluoro-anisaldehyde,pubchem1448,acmc-209idn,2-fluoro-4-formylanisole
IUPAC Name 3-fluoro-4-methoxybenzaldehyde
InChI Key SOQCZBSZZLWDGU-UHFFFAOYSA-N
Molecular Formula C8H7FO2
3,768

Benzoyl isothiocyanate, 98%

CAS: 532-55-8 Molecular Formula: C8H5NOS Molecular Weight (g/mol): 163.2 MDL Number: MFCD00004815 InChI Key: CPEKAXYCDKETEN-UHFFFAOYSA-N Synonym: benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone PubChem CID: 68284 IUPAC Name: benzoyl isothiocyanate SMILES: C1=CC=C(C=C1)C(=O)N=C=S

PubChem CID 68284
CAS 532-55-8
Molecular Weight (g/mol) 163.2
MDL Number MFCD00004815
SMILES C1=CC=C(C=C1)C(=O)N=C=S
Synonym benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone
IUPAC Name benzoyl isothiocyanate
InChI Key CPEKAXYCDKETEN-UHFFFAOYSA-N
Molecular Formula C8H5NOS
3,769

4-(Methylthio)benzaldehyde, 97%

CAS: 3446-89-7 Molecular Formula: C8H8OS Molecular Weight (g/mol): 152.21 MDL Number: MFCD00006948 InChI Key: QRVYABWJVXXOTN-UHFFFAOYSA-N Synonym: 4-methylthio benzaldehyde,benzaldehyde, 4-methylthio,4-methylsulfanyl benzaldehyde,4-methylmercaptobenzaldehyde,p-methylthio benzaldehyde,p-methylthiobenzaldehyde,unii-1tvq11biy8,4-aldehyde thioanisole,p-methylmercaptobenzaldehyde PubChem CID: 76985 IUPAC Name: 4-methylsulfanylbenzaldehyde SMILES: CSC1=CC=C(C=C1)C=O

PubChem CID 76985
CAS 3446-89-7
Molecular Weight (g/mol) 152.21
MDL Number MFCD00006948
SMILES CSC1=CC=C(C=C1)C=O
Synonym 4-methylthio benzaldehyde,benzaldehyde, 4-methylthio,4-methylsulfanyl benzaldehyde,4-methylmercaptobenzaldehyde,p-methylthio benzaldehyde,p-methylthiobenzaldehyde,unii-1tvq11biy8,4-aldehyde thioanisole,p-methylmercaptobenzaldehyde
IUPAC Name 4-methylsulfanylbenzaldehyde
InChI Key QRVYABWJVXXOTN-UHFFFAOYSA-N
Molecular Formula C8H8OS
3,770

Ethyl mesitylglyoxylate, 97%

CAS: 5524-57-2 Molecular Formula: C13H16O3 Molecular Weight (g/mol): 220.268 MDL Number: MFCD00151821 InChI Key: XRSPPFOBPRPYLD-UHFFFAOYSA-N Synonym: ethyl mesitylglyoxylate,ethyl 2-mesityl-2-oxoacetate,ethyl 2-oxo-2-2,4,6-trimethylphenyl acetate,acmc-1asq7,mesitylglyoxylic acid ethyl ester,ethyl 2,4,6-trimethylphenyl glyoxylate,alpha-oxo-2,4,6-trimethylbenzeneacetic acid ethyl ester PubChem CID: 2736481 IUPAC Name: ethyl 2-oxo-2-(2,4,6-trimethylphenyl)acetate SMILES: CCOC(=O)C(=O)C1=C(C=C(C=C1C)C)C

PubChem CID 2736481
CAS 5524-57-2
Molecular Weight (g/mol) 220.268
MDL Number MFCD00151821
SMILES CCOC(=O)C(=O)C1=C(C=C(C=C1C)C)C
Synonym ethyl mesitylglyoxylate,ethyl 2-mesityl-2-oxoacetate,ethyl 2-oxo-2-2,4,6-trimethylphenyl acetate,acmc-1asq7,mesitylglyoxylic acid ethyl ester,ethyl 2,4,6-trimethylphenyl glyoxylate,alpha-oxo-2,4,6-trimethylbenzeneacetic acid ethyl ester
IUPAC Name ethyl 2-oxo-2-(2,4,6-trimethylphenyl)acetate
InChI Key XRSPPFOBPRPYLD-UHFFFAOYSA-N
Molecular Formula C13H16O3
3,771

4-Formylbenzeneboronic acid pinacol ester, 98%

CAS: 128376-64-7 Molecular Formula: C13H17BO3 Molecular Weight (g/mol): 232.09 MDL Number: MFCD04972375 InChI Key: DMBMXJJGPXADPO-UHFFFAOYSA-N Synonym: 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,4-formylphenylboronic acid pinacol ester,4-formylbenzeneboronic acid, pinacol ester,4-formylphenylboronic acid pinacolate,4-formylphenylboronic acid pinacol cyclic ester,4-formylphenylboronic acid, pinacol ester,4-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,4-formylbenzeneboronic acid pinacol ester,benzaldehyde, 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,4-formylphenylboronic acid, pinacol cyclic ester PubChem CID: 2769536 IUPAC Name: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(C=O)C=C1

PubChem CID 2769536
CAS 128376-64-7
Molecular Weight (g/mol) 232.09
MDL Number MFCD04972375
SMILES CC1(C)OB(OC1(C)C)C1=CC=C(C=O)C=C1
Synonym 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,4-formylphenylboronic acid pinacol ester,4-formylbenzeneboronic acid, pinacol ester,4-formylphenylboronic acid pinacolate,4-formylphenylboronic acid pinacol cyclic ester,4-formylphenylboronic acid, pinacol ester,4-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,4-formylbenzeneboronic acid pinacol ester,benzaldehyde, 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,4-formylphenylboronic acid, pinacol cyclic ester
IUPAC Name 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
InChI Key DMBMXJJGPXADPO-UHFFFAOYSA-N
Molecular Formula C13H17BO3
3,772

Ethyl 3-aminobenzoate, 98%

CAS: 582-33-2 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 MDL Number: MFCD00007794 InChI Key: ZMCBYSBVJIMENC-UHFFFAOYSA-N Synonym: 3-aminobenzoic acid ethyl ester,m-ethoxycarbonylaniline,3-ethoxycarbonyl aniline,ethyl m-aminobenzoate,benzoic acid, 3-amino-, ethyl ester,m-aminobenzoic acid, ethyl ester,m-aminobenzoate,metacaine,3-amino-benzoic acid ethyl ester,benzoic acid, m-amino-, ethyl ester PubChem CID: 11400 ChEBI: CHEBI:81494 IUPAC Name: ethyl 3-aminobenzoate SMILES: CCOC(=O)C1=CC(=CC=C1)N

PubChem CID 11400
CAS 582-33-2
Molecular Weight (g/mol) 165.192
ChEBI CHEBI:81494
MDL Number MFCD00007794
SMILES CCOC(=O)C1=CC(=CC=C1)N
Synonym 3-aminobenzoic acid ethyl ester,m-ethoxycarbonylaniline,3-ethoxycarbonyl aniline,ethyl m-aminobenzoate,benzoic acid, 3-amino-, ethyl ester,m-aminobenzoic acid, ethyl ester,m-aminobenzoate,metacaine,3-amino-benzoic acid ethyl ester,benzoic acid, m-amino-, ethyl ester
IUPAC Name ethyl 3-aminobenzoate
InChI Key ZMCBYSBVJIMENC-UHFFFAOYSA-N
Molecular Formula C9H11NO2
3,773

4-(3-Bromothien-2-yl)benzaldehyde, 97%, Thermo Scientific™

CAS: 934570-51-1 Molecular Formula: C11H7BrOS Molecular Weight (g/mol): 267.14 MDL Number: MFCD09879968 InChI Key: BTYZFUJFFBNJTP-UHFFFAOYSA-N Synonym: 4-3-bromothien-2-yl benzaldehyde,4-3-bromothiophen-2-yl benzaldehyde PubChem CID: 24229751 IUPAC Name: 4-(3-bromothiophen-2-yl)benzaldehyde SMILES: C1=CC(=CC=C1C=O)C2=C(C=CS2)Br

PubChem CID 24229751
CAS 934570-51-1
Molecular Weight (g/mol) 267.14
MDL Number MFCD09879968
SMILES C1=CC(=CC=C1C=O)C2=C(C=CS2)Br
Synonym 4-3-bromothien-2-yl benzaldehyde,4-3-bromothiophen-2-yl benzaldehyde
IUPAC Name 4-(3-bromothiophen-2-yl)benzaldehyde
InChI Key BTYZFUJFFBNJTP-UHFFFAOYSA-N
Molecular Formula C11H7BrOS
3,774

m-Anisaldehyde, 97%

CAS: 591-31-1 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 InChI Key: WMPDAIZRQDCGFH-UHFFFAOYSA-N Synonym: m-anisaldehyde,3-anisaldehyde,benzaldehyde, 3-methoxy,m-methoxybenzaldehyde,metamethoxybenzaldehyde,3-methoxy-benzaldehyde,unii-8zao7s0ivh,ccris 960,meta-anisaldehyde,8zao7s0ivh PubChem CID: 11569 IUPAC Name: 3-methoxybenzaldehyde SMILES: COC1=CC=CC(=C1)C=O

PubChem CID 11569
CAS 591-31-1
Molecular Weight (g/mol) 136.15
SMILES COC1=CC=CC(=C1)C=O
Synonym m-anisaldehyde,3-anisaldehyde,benzaldehyde, 3-methoxy,m-methoxybenzaldehyde,metamethoxybenzaldehyde,3-methoxy-benzaldehyde,unii-8zao7s0ivh,ccris 960,meta-anisaldehyde,8zao7s0ivh
IUPAC Name 3-methoxybenzaldehyde
InChI Key WMPDAIZRQDCGFH-UHFFFAOYSA-N
Molecular Formula C8H8O2
3,775

4-Bromobenzylsulfonyl chloride, 95%, Thermo Scientific Chemicals

CAS: 53531-69-4 Molecular Formula: C7H6BrClO2S Molecular Weight (g/mol): 269.55 InChI Key: ZWVWFWGJZPHCHF-UHFFFAOYSA-N Synonym: 4-bromobenzylsulfonyl chloride,4-bromophenyl methanesulfonyl chloride,4-bromobenzylsulphonyl chloride,benzenemethanesulfonyl chloride, 4-bromo,4-bromophenyl methanesulphonyl chloride,4-bromophenyl methyl chlorosulfone,4-bromo-phenyl-methanesulfonyl chloride,4-bromo-benzenemethanesulfonyl chloride,pubchem2155,acmc-209l8j PubChem CID: 598764 IUPAC Name: (4-bromophenyl)methanesulfonyl chloride SMILES: C1=CC(=CC=C1CS(=O)(=O)Cl)Br

PubChem CID 598764
CAS 53531-69-4
Molecular Weight (g/mol) 269.55
SMILES C1=CC(=CC=C1CS(=O)(=O)Cl)Br
Synonym 4-bromobenzylsulfonyl chloride,4-bromophenyl methanesulfonyl chloride,4-bromobenzylsulphonyl chloride,benzenemethanesulfonyl chloride, 4-bromo,4-bromophenyl methanesulphonyl chloride,4-bromophenyl methyl chlorosulfone,4-bromo-phenyl-methanesulfonyl chloride,4-bromo-benzenemethanesulfonyl chloride,pubchem2155,acmc-209l8j
IUPAC Name (4-bromophenyl)methanesulfonyl chloride
InChI Key ZWVWFWGJZPHCHF-UHFFFAOYSA-N
Molecular Formula C7H6BrClO2S
3,776

4-Bromomandelic acid, 98+%

CAS: 6940-50-7 Molecular Formula: C8H7BrO3 Molecular Weight (g/mol): 231.05 MDL Number: MFCD00004232 InChI Key: BHZBRPQOYFDTAB-UHFFFAOYNA-N Synonym: 4-bromomandelic acid,2-4-bromophenyl-2-hydroxyacetic acid,p-bromomandelic acid,p-bromo mandelic acid,4-bromo-dl-mandelic acid,benzeneacetic acid, 4-bromo-.alpha.-hydroxy,4-bromophenyl hydroxy acetic acid,4-bromo-alpha-hydroxyphenylacetic acid,4-bromo-hydroxybenzeneaceticacid,mandelic acid, p-bromo PubChem CID: 97930 IUPAC Name: 2-(4-bromophenyl)-2-hydroxyacetic acid SMILES: OC(C(O)=O)C1=CC=C(Br)C=C1

PubChem CID 97930
CAS 6940-50-7
Molecular Weight (g/mol) 231.05
MDL Number MFCD00004232
SMILES OC(C(O)=O)C1=CC=C(Br)C=C1
Synonym 4-bromomandelic acid,2-4-bromophenyl-2-hydroxyacetic acid,p-bromomandelic acid,p-bromo mandelic acid,4-bromo-dl-mandelic acid,benzeneacetic acid, 4-bromo-.alpha.-hydroxy,4-bromophenyl hydroxy acetic acid,4-bromo-alpha-hydroxyphenylacetic acid,4-bromo-hydroxybenzeneaceticacid,mandelic acid, p-bromo
IUPAC Name 2-(4-bromophenyl)-2-hydroxyacetic acid
InChI Key BHZBRPQOYFDTAB-UHFFFAOYNA-N
Molecular Formula C8H7BrO3
3,777

3-Bromotoluene, 98%, Thermo Scientific Chemicals

CAS: 591-17-3 Molecular Formula: C7H7Br Molecular Weight (g/mol): 171.04 MDL Number: MFCD00000085 InChI Key: WJIFKOVZNJTSGO-UHFFFAOYSA-N Synonym: 3-bromotoluene,m-bromotoluene,3-methylbromobenzene,benzene, 1-bromo-3-methyl,m-tolyl bromide,toluene, m-bromo,5-bromotoluene,3-bromo-1-methylbenzene,m-methylbromobenzene,3-methyl-1-bromobenzene PubChem CID: 11560 IUPAC Name: 1-bromo-3-methylbenzene SMILES: CC1=CC=CC(Br)=C1

PubChem CID 11560
CAS 591-17-3
Molecular Weight (g/mol) 171.04
MDL Number MFCD00000085
SMILES CC1=CC=CC(Br)=C1
Synonym 3-bromotoluene,m-bromotoluene,3-methylbromobenzene,benzene, 1-bromo-3-methyl,m-tolyl bromide,toluene, m-bromo,5-bromotoluene,3-bromo-1-methylbenzene,m-methylbromobenzene,3-methyl-1-bromobenzene
IUPAC Name 1-bromo-3-methylbenzene
InChI Key WJIFKOVZNJTSGO-UHFFFAOYSA-N
Molecular Formula C7H7Br
3,778

4-(4-Bromophenyl)-1,2,3-thiadiazole, 97%, Thermo Scientific™

CAS: 40753-13-7 Molecular Formula: C8H5BrN2S Molecular Weight (g/mol): 241.106 MDL Number: MFCD00084907 InChI Key: HGWOTVRPRHVJQK-UHFFFAOYSA-N PubChem CID: 218520 IUPAC Name: 4-(4-bromophenyl)thiadiazole SMILES: C1=CC(=CC=C1C2=CSN=N2)Br

PubChem CID 218520
CAS 40753-13-7
Molecular Weight (g/mol) 241.106
MDL Number MFCD00084907
SMILES C1=CC(=CC=C1C2=CSN=N2)Br
IUPAC Name 4-(4-bromophenyl)thiadiazole
InChI Key HGWOTVRPRHVJQK-UHFFFAOYSA-N
Molecular Formula C8H5BrN2S
3,779

2,5-Dibromotoluene, 98%, Thermo Scientific Chemicals

CAS: 615-59-8 Molecular Formula: C7H6Br2 Molecular Weight (g/mol): 249.93 MDL Number: MFCD00000090 InChI Key: QKEZTJYRBHOKHH-UHFFFAOYSA-N Synonym: 2,5-dibromotoluene,benzene, 1,4-dibromo-2-methyl,toluene, 2,5-dibromo,2,5-dibromo toluene,3,6-dibromotoluene,1,4-dibromo-2-methyl-benzene,pubchem3922,acmc-209mu2,chemwish ic06904 PubChem CID: 12006 IUPAC Name: 1,4-dibromo-2-methylbenzene SMILES: CC1=C(C=CC(=C1)Br)Br

PubChem CID 12006
CAS 615-59-8
Molecular Weight (g/mol) 249.93
MDL Number MFCD00000090
SMILES CC1=C(C=CC(=C1)Br)Br
Synonym 2,5-dibromotoluene,benzene, 1,4-dibromo-2-methyl,toluene, 2,5-dibromo,2,5-dibromo toluene,3,6-dibromotoluene,1,4-dibromo-2-methyl-benzene,pubchem3922,acmc-209mu2,chemwish ic06904
IUPAC Name 1,4-dibromo-2-methylbenzene
InChI Key QKEZTJYRBHOKHH-UHFFFAOYSA-N
Molecular Formula C7H6Br2
3,780

1-Bromo-2-nitrobenzene, 98%

CAS: 577-19-5 Molecular Formula: C6H4BrNO2 Molecular Weight (g/mol): 202.01 MDL Number: MFCD00007045 InChI Key: ORPVVAKYSXQCJI-UHFFFAOYSA-N Synonym: 2-bromonitrobenzene,o-bromonitrobenzene,o-nitrobromobenzene,2-nitrobromobenzene,benzene, 1-bromo-2-nitro,o-nitrophenyl bromide,2-bromo-1-nitrobenzene,1-bromo-2-nitro-benzene,2-bromo nitrobenzene,benzene, bromonitro PubChem CID: 11341 IUPAC Name: 1-bromo-2-nitrobenzene SMILES: C1=CC=C(C(=C1)[N+](=O)[O-])Br

PubChem CID 11341
CAS 577-19-5
Molecular Weight (g/mol) 202.01
MDL Number MFCD00007045
SMILES C1=CC=C(C(=C1)[N+](=O)[O-])Br
Synonym 2-bromonitrobenzene,o-bromonitrobenzene,o-nitrobromobenzene,2-nitrobromobenzene,benzene, 1-bromo-2-nitro,o-nitrophenyl bromide,2-bromo-1-nitrobenzene,1-bromo-2-nitro-benzene,2-bromo nitrobenzene,benzene, bromonitro
IUPAC Name 1-bromo-2-nitrobenzene
InChI Key ORPVVAKYSXQCJI-UHFFFAOYSA-N
Molecular Formula C6H4BrNO2