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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 (64,917)
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Naphthalenes (4,958)
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Unsubstituted Phenols (1,173)
Thiophenols (609)
Phenol esters (426)
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1-hydroxylamino 2-unsubstituted benzenoids (5)

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5,506 – 5,520 of 73,799 results
5,506

2-Naphthol, 98+%

CAS: 135-19-3 Molecular Formula: C10H8O Molecular Weight (g/mol): 144.173 MDL Number: MFCD00004067 InChI Key: JWAZRIHNYRIHIV-UHFFFAOYSA-N Synonym: 2-naphthol,2-naphthalenol,beta-naphthol,2-hydroxynaphthalene,betanaphthol,isonaphthol,developer bn,naphthol b,azogen developer a,beta-napthol PubChem CID: 8663 ChEBI: CHEBI:10432 IUPAC Name: naphthalen-2-ol SMILES: C1=CC=C2C=C(C=CC2=C1)O

PubChem CID 8663
CAS 135-19-3
Molecular Weight (g/mol) 144.173
ChEBI CHEBI:10432
MDL Number MFCD00004067
SMILES C1=CC=C2C=C(C=CC2=C1)O
Synonym 2-naphthol,2-naphthalenol,beta-naphthol,2-hydroxynaphthalene,betanaphthol,isonaphthol,developer bn,naphthol b,azogen developer a,beta-napthol
IUPAC Name naphthalen-2-ol
InChI Key JWAZRIHNYRIHIV-UHFFFAOYSA-N
Molecular Formula C10H8O
5,507

Terephthalaldehyde, 98%

CAS: 623-27-8 Molecular Formula: C8H6O2 Molecular Weight (g/mol): 134.134 MDL Number: MFCD00006949 InChI Key: KUCOHFSKRZZVRO-UHFFFAOYSA-N Synonym: 1,4-benzenedicarboxaldehyde,p-phthalaldehyde,terephthaldehyde,terephthaldialdehyde,terephthaladehyde,terephthaldicarboxaldehyde,terephthalic aldehyde,1,4-phthalaldehyde,p-formylbenzaldehyde,terephtaldehyde PubChem CID: 12173 IUPAC Name: terephthalaldehyde SMILES: C1=CC(=CC=C1C=O)C=O

PubChem CID 12173
CAS 623-27-8
Molecular Weight (g/mol) 134.134
MDL Number MFCD00006949
SMILES C1=CC(=CC=C1C=O)C=O
Synonym 1,4-benzenedicarboxaldehyde,p-phthalaldehyde,terephthaldehyde,terephthaldialdehyde,terephthaladehyde,terephthaldicarboxaldehyde,terephthalic aldehyde,1,4-phthalaldehyde,p-formylbenzaldehyde,terephtaldehyde
IUPAC Name terephthalaldehyde
InChI Key KUCOHFSKRZZVRO-UHFFFAOYSA-N
Molecular Formula C8H6O2
5,508

4-Bromo-2-fluoro-5-(trifluoromethyl)aniline, 97%

CAS: 104460-70-0 Molecular Formula: C7H4BrF4N Molecular Weight (g/mol): 258.01 MDL Number: MFCD04973757 InChI Key: UYVDMCXPDGRLEC-UHFFFAOYSA-N Synonym: 4-bromo-2-fluoro-5-trifluoromethyl aniline,benzenamine, 4-bromo-2-fluoro-5-trifluoromethyl,benzenamine,4-bromo-2-fluoro-5-trifluoromethyl,acmc-209ygd,4-bromo-2-fluoro-5-trifluoromethyl phenylamine,4-bromanyl-2-fluoranyl-5-trifluoromethyl aniline PubChem CID: 7018046 IUPAC Name: 4-bromo-2-fluoro-5-(trifluoromethyl)aniline SMILES: NC1=C(F)C=C(Br)C(=C1)C(F)(F)F

PubChem CID 7018046
CAS 104460-70-0
Molecular Weight (g/mol) 258.01
MDL Number MFCD04973757
SMILES NC1=C(F)C=C(Br)C(=C1)C(F)(F)F
Synonym 4-bromo-2-fluoro-5-trifluoromethyl aniline,benzenamine, 4-bromo-2-fluoro-5-trifluoromethyl,benzenamine,4-bromo-2-fluoro-5-trifluoromethyl,acmc-209ygd,4-bromo-2-fluoro-5-trifluoromethyl phenylamine,4-bromanyl-2-fluoranyl-5-trifluoromethyl aniline
IUPAC Name 4-bromo-2-fluoro-5-(trifluoromethyl)aniline
InChI Key UYVDMCXPDGRLEC-UHFFFAOYSA-N
Molecular Formula C7H4BrF4N
5,509

(2-Butenyl)triphenylphosphonium chloride, 97%

CAS: 13138-25-5 Molecular Formula: C22H22ClP Molecular Weight (g/mol): 352.84 MDL Number: MFCD00051868 InChI Key: YYTDJYJBYMQMDI-SQQVDAMQSA-M Synonym: 2-butenyl triphenylphosphonium chloride,but-2-en-1-yltriphenylphosphonium chloride,2e-but-2-en-1-yltriphenylphosphanium chloride PubChem CID: 11824356 IUPAC Name: [(E)-but-2-enyl]-triphenylphosphanium;chloride SMILES: [Cl-].C\C=C\C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 11824356
CAS 13138-25-5
Molecular Weight (g/mol) 352.84
MDL Number MFCD00051868
SMILES [Cl-].C\C=C\C[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym 2-butenyl triphenylphosphonium chloride,but-2-en-1-yltriphenylphosphonium chloride,2e-but-2-en-1-yltriphenylphosphanium chloride
IUPAC Name [(E)-but-2-enyl]-triphenylphosphanium;chloride
InChI Key YYTDJYJBYMQMDI-SQQVDAMQSA-M
Molecular Formula C22H22ClP
5,510

2-Chloro-5-(trifluoromethyl)phenyl isocyanate, 97%

CAS: 50528-86-4 Molecular Formula: C8H3ClF3NO Molecular Weight (g/mol): 221.563 MDL Number: MFCD00037029 InChI Key: WEPYOPYMWSHRIW-UHFFFAOYSA-N Synonym: 2-chloro-5-trifluoromethyl phenyl isocyanate,1-chloro-2-isocyanato-4-trifluoromethyl benzene,isocyanic acid 2-chloro-5-trifluoromethyl phenyl ester,2-chloro-5-trifluoromethylphenyl isocyanate,2-chloro-5-trifluoromethyl phenylisocyanate,2-chloro-5-trifluoromethyl benzenisocyanate,pubchem5026,acmc-1aq1j,timtec-bb sbb006656,1-mercapto-2-methyl-propan-2-ol PubChem CID: 2733263 IUPAC Name: 1-chloro-2-isocyanato-4-(trifluoromethyl)benzene SMILES: C1=CC(=C(C=C1C(F)(F)F)N=C=O)Cl

PubChem CID 2733263
CAS 50528-86-4
Molecular Weight (g/mol) 221.563
MDL Number MFCD00037029
SMILES C1=CC(=C(C=C1C(F)(F)F)N=C=O)Cl
Synonym 2-chloro-5-trifluoromethyl phenyl isocyanate,1-chloro-2-isocyanato-4-trifluoromethyl benzene,isocyanic acid 2-chloro-5-trifluoromethyl phenyl ester,2-chloro-5-trifluoromethylphenyl isocyanate,2-chloro-5-trifluoromethyl phenylisocyanate,2-chloro-5-trifluoromethyl benzenisocyanate,pubchem5026,acmc-1aq1j,timtec-bb sbb006656,1-mercapto-2-methyl-propan-2-ol
IUPAC Name 1-chloro-2-isocyanato-4-(trifluoromethyl)benzene
InChI Key WEPYOPYMWSHRIW-UHFFFAOYSA-N
Molecular Formula C8H3ClF3NO
5,511

4-Chloro-3-nitrophenol, 99%

CAS: 610-78-6 Molecular Formula: C6H4ClNO3 Molecular Weight (g/mol): 173.552 MDL Number: MFCD00043546 InChI Key: JUIKCULGDIZNDI-UHFFFAOYSA-N PubChem CID: 69127 IUPAC Name: 4-chloro-3-nitrophenol SMILES: C1=CC(=C(C=C1O)[N+](=O)[O-])Cl

PubChem CID 69127
CAS 610-78-6
Molecular Weight (g/mol) 173.552
MDL Number MFCD00043546
SMILES C1=CC(=C(C=C1O)[N+](=O)[O-])Cl
IUPAC Name 4-chloro-3-nitrophenol
InChI Key JUIKCULGDIZNDI-UHFFFAOYSA-N
Molecular Formula C6H4ClNO3
5,512

4-Fluoro-2-methoxybenzaldehyde, 98%, Thermo Scientific Chemicals

CAS: 450-83-9 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00143318 InChI Key: PTKRQIRPNNIORO-UHFFFAOYSA-N Synonym: 2-methoxy-4-fluorobenzaldehyde,benzaldehyde, 4-fluoro-2-methoxy,4-fluoro-2-methoxy-benzaldehyde,4-fluoro-o-anisaldehyde,fluoromethoxybenzaldehyde4,pubchem2635,5-fluoro-2-formylanisole,acmc-1ags2,ksc494s3t,4-fluoro-2-methoxybenzal dehyde PubChem CID: 2774537 IUPAC Name: 4-fluoro-2-methoxybenzaldehyde SMILES: COC1=CC(F)=CC=C1C=O

PubChem CID 2774537
CAS 450-83-9
Molecular Weight (g/mol) 154.14
MDL Number MFCD00143318
SMILES COC1=CC(F)=CC=C1C=O
Synonym 2-methoxy-4-fluorobenzaldehyde,benzaldehyde, 4-fluoro-2-methoxy,4-fluoro-2-methoxy-benzaldehyde,4-fluoro-o-anisaldehyde,fluoromethoxybenzaldehyde4,pubchem2635,5-fluoro-2-formylanisole,acmc-1ags2,ksc494s3t,4-fluoro-2-methoxybenzal dehyde
IUPAC Name 4-fluoro-2-methoxybenzaldehyde
InChI Key PTKRQIRPNNIORO-UHFFFAOYSA-N
Molecular Formula C8H7FO2
5,513

2-(4-Methoxyphenyl)ethanol, 98%

CAS: 702-23-8 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00002900 InChI Key: AUWDOZOUJWEPBA-UHFFFAOYSA-N Synonym: 2-4-methoxyphenyl ethanol,4-methoxyphenethyl alcohol,4-methoxybenzeneethanol,benzeneethanol, 4-methoxy,p-methoxyphenethyl alcohol,2-4-methoxyphenyl ethan-1-ol,unii-3mwl5nze9k,3mwl5nze9k,4-2-hydroxyethyl anisole,2-4-methoxyphenyl-ethanol PubChem CID: 69705 IUPAC Name: 2-(4-methoxyphenyl)ethanol SMILES: COC1=CC=C(C=C1)CCO

PubChem CID 69705
CAS 702-23-8
Molecular Weight (g/mol) 152.193
MDL Number MFCD00002900
SMILES COC1=CC=C(C=C1)CCO
Synonym 2-4-methoxyphenyl ethanol,4-methoxyphenethyl alcohol,4-methoxybenzeneethanol,benzeneethanol, 4-methoxy,p-methoxyphenethyl alcohol,2-4-methoxyphenyl ethan-1-ol,unii-3mwl5nze9k,3mwl5nze9k,4-2-hydroxyethyl anisole,2-4-methoxyphenyl-ethanol
IUPAC Name 2-(4-methoxyphenyl)ethanol
InChI Key AUWDOZOUJWEPBA-UHFFFAOYSA-N
Molecular Formula C9H12O2
5,514

2-[(4-Fluorophenyl)thio]acetic acid, 97%, Thermo Scientific™

CAS: 332-51-4 Molecular Formula: C8H7FO2S Molecular Weight (g/mol): 186.2 MDL Number: MFCD00219825 InChI Key: HQEROVXUKINLPI-UHFFFAOYSA-N Synonym: 4-fluorophenylthio acetic acid,2-4-fluorophenylthio acetic acid,2-4-fluorophenyl thio acetic acid,4-fluorophenyl thio acetic acid,4-fluorophenyl sulfanyl acetic acid,maybridge1_004918,acmc-20apn5,4-fluoro-phenylsulfanyl-acetic acid,2-4-fluorophenyl sulfanylacetic acid PubChem CID: 736197 IUPAC Name: 2-(4-fluorophenyl)sulfanylacetic acid SMILES: C1=CC(=CC=C1F)SCC(=O)O

PubChem CID 736197
CAS 332-51-4
Molecular Weight (g/mol) 186.2
MDL Number MFCD00219825
SMILES C1=CC(=CC=C1F)SCC(=O)O
Synonym 4-fluorophenylthio acetic acid,2-4-fluorophenylthio acetic acid,2-4-fluorophenyl thio acetic acid,4-fluorophenyl thio acetic acid,4-fluorophenyl sulfanyl acetic acid,maybridge1_004918,acmc-20apn5,4-fluoro-phenylsulfanyl-acetic acid,2-4-fluorophenyl sulfanylacetic acid
IUPAC Name 2-(4-fluorophenyl)sulfanylacetic acid
InChI Key HQEROVXUKINLPI-UHFFFAOYSA-N
Molecular Formula C8H7FO2S
5,515

2,4,6-Trichlorophenol, 98%

CAS: 88-06-2 Molecular Formula: C6H3Cl3O MDL Number: MFCD00002172 InChI Key: LINPIYWFGCPVIE-UHFFFAOYSA-N PubChem CID: 6914 ChEBI: CHEBI:28755 IUPAC Name: 2,4,6-trichlorophenol

PubChem CID 6914
CAS 88-06-2
ChEBI CHEBI:28755
MDL Number MFCD00002172
IUPAC Name 2,4,6-trichlorophenol
InChI Key LINPIYWFGCPVIE-UHFFFAOYSA-N
Molecular Formula C6H3Cl3O
5,516

5'-O-(4,4'-Dimethoxytrityl)-2'-deoxyinosine, 98%

CAS: 93778-57-5 Molecular Formula: C31H30N4O6 Molecular Weight (g/mol): 554.60 MDL Number: MFCD00057879 InChI Key: IYNGMVFRUKBGNM-OQAPVCBANA-N Synonym: 5'-o-4,4'-dimethoxytrityl-2'-deoxyinosine,dmt-di,2'-deoxy-5'-o-dmt-inosine,9-2r,4s,5r-5-bis 4-methoxyphenyl phenyl methoxy methyl-4-hydroxyoxolan-2-yl purin-6-ol,inosine,5'-o-bis 4-methoxyphenyl phenylmethyl-2'-deoxy,2'-deoxy-5'-o-dimethoxytrityl-inosine,2'-deoxy-5'-ortho-dmt-inosine,9-2r,4s,5r-5-bis 4-methoxyphenyl phenyl methoxy methyl-4-hydroxytetrahydrofuran-2-yl-9h-purin-6-ol,9-2r,4s,5r-5-bis 4-methoxyphenyl phenyl methoxy methyl-4-hydroxyoxolan-2-yl-1h-purin-6-one PubChem CID: 15277171 IUPAC Name: 9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]-3H-purin-6-one SMILES: COC1=CC=C(C=C1)C(OC[C@H]1O[C@H](C[C@@H]1O)N1C=NC2=C1N=CNC2=O)(C1=CC=CC=C1)C1=CC=C(OC)C=C1

PubChem CID 15277171
CAS 93778-57-5
Molecular Weight (g/mol) 554.60
MDL Number MFCD00057879
SMILES COC1=CC=C(C=C1)C(OC[C@H]1O[C@H](C[C@@H]1O)N1C=NC2=C1N=CNC2=O)(C1=CC=CC=C1)C1=CC=C(OC)C=C1
Synonym 5'-o-4,4'-dimethoxytrityl-2'-deoxyinosine,dmt-di,2'-deoxy-5'-o-dmt-inosine,9-2r,4s,5r-5-bis 4-methoxyphenyl phenyl methoxy methyl-4-hydroxyoxolan-2-yl purin-6-ol,inosine,5'-o-bis 4-methoxyphenyl phenylmethyl-2'-deoxy,2'-deoxy-5'-o-dimethoxytrityl-inosine,2'-deoxy-5'-ortho-dmt-inosine,9-2r,4s,5r-5-bis 4-methoxyphenyl phenyl methoxy methyl-4-hydroxytetrahydrofuran-2-yl-9h-purin-6-ol,9-2r,4s,5r-5-bis 4-methoxyphenyl phenyl methoxy methyl-4-hydroxyoxolan-2-yl-1h-purin-6-one
IUPAC Name 9-[(2R,4S,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-4-hydroxyoxolan-2-yl]-3H-purin-6-one
InChI Key IYNGMVFRUKBGNM-OQAPVCBANA-N
Molecular Formula C31H30N4O6
5,517

2-Amino-3-chlorobenzoic acid, 98%

CAS: 6388-47-2 Molecular Formula: C7H6ClNO2 Molecular Weight (g/mol): 171.58 MDL Number: MFCD00134229 InChI Key: LWUAMROXVQLJKA-UHFFFAOYSA-N Synonym: 3-chloroanthranilic acid,benzoic acid, 2-amino-3-chloro,2-amino-3-chloro-benzoic acid,3-chloro-2-aminobenzoic acid,anthranilic acid, 3-chloro,2-amino-3-chlorobenzoicacid,pubchem4639,3-chloroanthranilicacid,acmc-209nj4,amino-3-chlorobenzoic acid PubChem CID: 80807 IUPAC Name: 2-amino-3-chlorobenzoic acid SMILES: NC1=C(Cl)C=CC=C1C(O)=O

PubChem CID 80807
CAS 6388-47-2
Molecular Weight (g/mol) 171.58
MDL Number MFCD00134229
SMILES NC1=C(Cl)C=CC=C1C(O)=O
Synonym 3-chloroanthranilic acid,benzoic acid, 2-amino-3-chloro,2-amino-3-chloro-benzoic acid,3-chloro-2-aminobenzoic acid,anthranilic acid, 3-chloro,2-amino-3-chlorobenzoicacid,pubchem4639,3-chloroanthranilicacid,acmc-209nj4,amino-3-chlorobenzoic acid
IUPAC Name 2-amino-3-chlorobenzoic acid
InChI Key LWUAMROXVQLJKA-UHFFFAOYSA-N
Molecular Formula C7H6ClNO2
5,518

4-Methylphenylacetone, 97+%

CAS: 2096-86-8 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.205 MDL Number: MFCD00017250 InChI Key: NOXKUHSBIXPZBJ-UHFFFAOYSA-N Synonym: 4-methylphenylacetone,1-4-methylphenyl propan-2-one,1-p-tolyl propan-2-one,4-methylphenyl acetone,1-4-methylphenyl acetone,p-methylphenyl acetone,1-4-methylphenyl-2-propanone,2-propanone,1-4-methylphenyl,p-methylphenylacetone,acmc-20amd6 PubChem CID: 137428 IUPAC Name: 1-(4-methylphenyl)propan-2-one SMILES: CC1=CC=C(C=C1)CC(=O)C

PubChem CID 137428
CAS 2096-86-8
Molecular Weight (g/mol) 148.205
MDL Number MFCD00017250
SMILES CC1=CC=C(C=C1)CC(=O)C
Synonym 4-methylphenylacetone,1-4-methylphenyl propan-2-one,1-p-tolyl propan-2-one,4-methylphenyl acetone,1-4-methylphenyl acetone,p-methylphenyl acetone,1-4-methylphenyl-2-propanone,2-propanone,1-4-methylphenyl,p-methylphenylacetone,acmc-20amd6
IUPAC Name 1-(4-methylphenyl)propan-2-one
InChI Key NOXKUHSBIXPZBJ-UHFFFAOYSA-N
Molecular Formula C10H12O
5,519

N-Methyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzylamine, 95%, Thermo Scientific™

CAS: 944450-83-3 Molecular Formula: C11H13N3O Molecular Weight (g/mol): 203.245 MDL Number: MFCD11109326 InChI Key: PBJZWGQLXKZEJT-UHFFFAOYSA-N Synonym: n-methyl-4-5-methyl-1,3,4-oxadiazol-2-yl benzylamine,methyl 4-5-methyl-1,3,4-oxadiazol-2-yl phenyl methyl amine,2-4-methyl aminomethyl phenyl-5-methyl-1,3,4-oxadiazole,methyl 4-5-methyl 1,3,4-oxadiazol-2-yl phenyl methyl amine,n-methyl-1-4-5-methyl-1,3,4-oxadiazol-2-yl phenyl methanamine,n-methyl-1-4-5-methyl-1,3,4-oxadiazol-2-yl phenyl methylamine PubChem CID: 26343642 IUPAC Name: N-methyl-1-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]methanamine SMILES: CC1=NN=C(O1)C2=CC=C(C=C2)CNC

PubChem CID 26343642
CAS 944450-83-3
Molecular Weight (g/mol) 203.245
MDL Number MFCD11109326
SMILES CC1=NN=C(O1)C2=CC=C(C=C2)CNC
Synonym n-methyl-4-5-methyl-1,3,4-oxadiazol-2-yl benzylamine,methyl 4-5-methyl-1,3,4-oxadiazol-2-yl phenyl methyl amine,2-4-methyl aminomethyl phenyl-5-methyl-1,3,4-oxadiazole,methyl 4-5-methyl 1,3,4-oxadiazol-2-yl phenyl methyl amine,n-methyl-1-4-5-methyl-1,3,4-oxadiazol-2-yl phenyl methanamine,n-methyl-1-4-5-methyl-1,3,4-oxadiazol-2-yl phenyl methylamine
IUPAC Name N-methyl-1-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]methanamine
InChI Key PBJZWGQLXKZEJT-UHFFFAOYSA-N
Molecular Formula C11H13N3O
5,520

5-[2-(Bromomethyl)phenyl]-3-methyl-1,2,4-oxadiazole, 97%, Thermo Scientific™

CAS: 892501-91-6 Molecular Formula: C10H9BrN2O Molecular Weight (g/mol): 253.10 MDL Number: MFCD09064955 InChI Key: GTXIOLDSSMKRDR-UHFFFAOYSA-N Synonym: 5-2-bromomethyl phenyl-3-methyl-1,2,4-oxadiazole,5-2-bromomethyl phenyl-3-methyl-1,2,4-oxadiazol,1,2,4-oxadiazole, 5-2-bromomethyl phenyl-3-methyl,2-3-methyl-1,2,4-oxadiazol-5-yl benzyl bromide,pubchem23328,1,2,4-oxadiazole,5-2-bromomethyl phenyl-3-methyl PubChem CID: 24229503 IUPAC Name: 5-[2-(bromomethyl)phenyl]-3-methyl-1,2,4-oxadiazole SMILES: CC1=NOC(=N1)C1=CC=CC=C1CBr

PubChem CID 24229503
CAS 892501-91-6
Molecular Weight (g/mol) 253.10
MDL Number MFCD09064955
SMILES CC1=NOC(=N1)C1=CC=CC=C1CBr
Synonym 5-2-bromomethyl phenyl-3-methyl-1,2,4-oxadiazole,5-2-bromomethyl phenyl-3-methyl-1,2,4-oxadiazol,1,2,4-oxadiazole, 5-2-bromomethyl phenyl-3-methyl,2-3-methyl-1,2,4-oxadiazol-5-yl benzyl bromide,pubchem23328,1,2,4-oxadiazole,5-2-bromomethyl phenyl-3-methyl
IUPAC Name 5-[2-(bromomethyl)phenyl]-3-methyl-1,2,4-oxadiazole
InChI Key GTXIOLDSSMKRDR-UHFFFAOYSA-N
Molecular Formula C10H9BrN2O