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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 (130,195)
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1-hydroxylamino 2-unsubstituted benzenoids (6)

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4,486 – 4,500 of 159,106 results
4,486

4,6-Dimethyl-2-nitroaniline, 97%

CAS: 1635-84-3 Molecular Formula: C8H10N2O2 Molecular Weight (g/mol): 166.18 InChI Key: VSRYYONYIUUFFY-UHFFFAOYSA-N Synonym: 4,6-dimethyl-2-nitroaniline,6-nitro-2,4-xylidine,2,4-dimethyl-6-nitrophenyl amine,benzenamine, 2,4-dimethyl-6-nitro,2,4-dimethyl-6-nitrophenylamine,acmc-209uyq,intermediates-zcf02230,4-amino-5-nitro-m-xylene,cambridge id 5100320,2-nitro-4,6-dimethylaniline PubChem CID: 74219 IUPAC Name: 2,4-dimethyl-6-nitroaniline SMILES: CC1=CC(=C(C(=C1)[N+](=O)[O-])N)C

PubChem CID 74219
CAS 1635-84-3
Molecular Weight (g/mol) 166.18
SMILES CC1=CC(=C(C(=C1)[N+](=O)[O-])N)C
Synonym 4,6-dimethyl-2-nitroaniline,6-nitro-2,4-xylidine,2,4-dimethyl-6-nitrophenyl amine,benzenamine, 2,4-dimethyl-6-nitro,2,4-dimethyl-6-nitrophenylamine,acmc-209uyq,intermediates-zcf02230,4-amino-5-nitro-m-xylene,cambridge id 5100320,2-nitro-4,6-dimethylaniline
IUPAC Name 2,4-dimethyl-6-nitroaniline
InChI Key VSRYYONYIUUFFY-UHFFFAOYSA-N
Molecular Formula C8H10N2O2
4,487
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Cinnamylideneacetophenone, 98+%

CAS: 614-57-3 Molecular Formula: C17H14O Molecular Weight (g/mol): 234.298 MDL Number: MFCD00020692 InChI Key: QONKLJMPKWQQFG-HPIZBCMHSA-N Synonym: cinnamylideneacetophenone,cinnamalacetophenone,5-phenyl-2,4-pentadienophenone,5-phenylpenta-2,4-dienophenone,2e,4e-1,5-diphenylpenta-2,4-dien-1-one,?,e-1,5-diphenyl-2,4-pentadien-1-one,2,4-pentadienophenone, 5-phenyl,2,4-pentadien-1-one, 1,5-diphenyl-, ?,e,1,5-diphenyl-2,4-pentadien-1-one,2,4-pentadien-1-one, 1,5-diphenyl PubChem CID: 1549519 IUPAC Name: (2E,4E)-1,5-diphenylpenta-2,4-dien-1-one SMILES: C1=CC=C(C=C1)C=CC=CC(=O)C2=CC=CC=C2

PubChem CID 1549519
CAS 614-57-3
Molecular Weight (g/mol) 234.298
MDL Number MFCD00020692
SMILES C1=CC=C(C=C1)C=CC=CC(=O)C2=CC=CC=C2
Synonym cinnamylideneacetophenone,cinnamalacetophenone,5-phenyl-2,4-pentadienophenone,5-phenylpenta-2,4-dienophenone,2e,4e-1,5-diphenylpenta-2,4-dien-1-one,?,e-1,5-diphenyl-2,4-pentadien-1-one,2,4-pentadienophenone, 5-phenyl,2,4-pentadien-1-one, 1,5-diphenyl-, ?,e,1,5-diphenyl-2,4-pentadien-1-one,2,4-pentadien-1-one, 1,5-diphenyl
IUPAC Name (2E,4E)-1,5-diphenylpenta-2,4-dien-1-one
InChI Key QONKLJMPKWQQFG-HPIZBCMHSA-N
Molecular Formula C17H14O
4,488
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5-Bromo-2-fluorobenzaldehyde, 98%

CAS: 93777-26-5 Molecular Formula: C7H4BrFO Molecular Weight (g/mol): 203.01 MDL Number: MFCD00070755 InChI Key: MMFGGDVQLQQQRX-UHFFFAOYSA-N Synonym: 2-fluoro-5-bromobenzaldehyde,5-bromo-2-fluoro-benzaldehyde,2-fluoro-5-bromo benzaldehyde,5-bromo-2-fluoro benzaldehyde,benzaldehyde, 5-bromo-2-fluoro,5-brom-2-fluorbenzaldehyd,pubchem2879,acmc-209rnk,3-bromo-6-fluorobenzaldehyde,ksc494e9t PubChem CID: 736327 IUPAC Name: 5-bromo-2-fluorobenzaldehyde SMILES: C1=CC(=C(C=C1Br)C=O)F

PubChem CID 736327
CAS 93777-26-5
Molecular Weight (g/mol) 203.01
MDL Number MFCD00070755
SMILES C1=CC(=C(C=C1Br)C=O)F
Synonym 2-fluoro-5-bromobenzaldehyde,5-bromo-2-fluoro-benzaldehyde,2-fluoro-5-bromo benzaldehyde,5-bromo-2-fluoro benzaldehyde,benzaldehyde, 5-bromo-2-fluoro,5-brom-2-fluorbenzaldehyd,pubchem2879,acmc-209rnk,3-bromo-6-fluorobenzaldehyde,ksc494e9t
IUPAC Name 5-bromo-2-fluorobenzaldehyde
InChI Key MMFGGDVQLQQQRX-UHFFFAOYSA-N
Molecular Formula C7H4BrFO
4,489
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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
4,490

4-(1-Methyl-1H-pyrazol-3-yl)benzoic acid, 97%, Thermo Scientific™

CAS: 915707-39-0 Molecular Formula: C11H10N2O2 Molecular Weight (g/mol): 202.21 MDL Number: MFCD09702346 InChI Key: ZIRNSRSOPMSFDK-UHFFFAOYSA-N Synonym: 4-1-methyl-1h-pyrazol-3-yl benzoic acid,4-1-methylpyrazol-3-yl benzoic acid,4-1-methyl-1h-pyrazol-3-yl benzoicacid PubChem CID: 24229466 IUPAC Name: 4-(1-methylpyrazol-3-yl)benzoic acid SMILES: CN1C=CC(=N1)C1=CC=C(C=C1)C(O)=O

PubChem CID 24229466
CAS 915707-39-0
Molecular Weight (g/mol) 202.21
MDL Number MFCD09702346
SMILES CN1C=CC(=N1)C1=CC=C(C=C1)C(O)=O
Synonym 4-1-methyl-1h-pyrazol-3-yl benzoic acid,4-1-methylpyrazol-3-yl benzoic acid,4-1-methyl-1h-pyrazol-3-yl benzoicacid
IUPAC Name 4-(1-methylpyrazol-3-yl)benzoic acid
InChI Key ZIRNSRSOPMSFDK-UHFFFAOYSA-N
Molecular Formula C11H10N2O2
4,491

3-(1H-Pyrazol-3-yl)benzoic acid, 97%, Thermo Scientific™

CAS: 850375-11-0 Molecular Formula: C10H8N2O2 Molecular Weight (g/mol): 188.19 MDL Number: MFCD03407956 InChI Key: RXZRBZWATRFHCS-UHFFFAOYSA-N Synonym: 3-1h-pyrazol-5-yl benzoic acid,3-1h-pyrazol-3-yl benzoic acid,3-2h-pyrazol-3-yl benzoic acid,benzoic acid, 3-1h-pyrazol-3-yl,5-3-carboxyphenyl-1h-pyrazole,pubchem22748,buttpark 44\01-87,d0tx9p,3-pyrazol-3-ylbenzoic acid,3-pyrazol-5-ylbenzoic acid PubChem CID: 2795542 IUPAC Name: 3-(1H-pyrazol-5-yl)benzoic acid SMILES: OC(=O)C1=CC=CC(=C1)C1=CC=NN1

PubChem CID 2795542
CAS 850375-11-0
Molecular Weight (g/mol) 188.19
MDL Number MFCD03407956
SMILES OC(=O)C1=CC=CC(=C1)C1=CC=NN1
Synonym 3-1h-pyrazol-5-yl benzoic acid,3-1h-pyrazol-3-yl benzoic acid,3-2h-pyrazol-3-yl benzoic acid,benzoic acid, 3-1h-pyrazol-3-yl,5-3-carboxyphenyl-1h-pyrazole,pubchem22748,buttpark 44\01-87,d0tx9p,3-pyrazol-3-ylbenzoic acid,3-pyrazol-5-ylbenzoic acid
IUPAC Name 3-(1H-pyrazol-5-yl)benzoic acid
InChI Key RXZRBZWATRFHCS-UHFFFAOYSA-N
Molecular Formula C10H8N2O2
4,492

3-(1H-Imidazol-1-ylmethyl)benzaldehyde, ≥97%, Thermo Scientific™

CAS: 102432-05-3 Molecular Formula: C11H10N2O Molecular Weight (g/mol): 186.214 MDL Number: MFCD08271917 InChI Key: JMKQKKQFLYPQDD-UHFFFAOYSA-N PubChem CID: 10397537 IUPAC Name: 3-(imidazol-1-ylmethyl)benzaldehyde SMILES: C1=CC(=CC(=C1)CN2C=CN=C2)C=O

PubChem CID 10397537
CAS 102432-05-3
Molecular Weight (g/mol) 186.214
MDL Number MFCD08271917
SMILES C1=CC(=CC(=C1)CN2C=CN=C2)C=O
IUPAC Name 3-(imidazol-1-ylmethyl)benzaldehyde
InChI Key JMKQKKQFLYPQDD-UHFFFAOYSA-N
Molecular Formula C11H10N2O
4,493
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2-Fluoro-6-methylbenzaldehyde, 97%

CAS: 117752-04-2 Molecular Formula: C8H7FO Molecular Weight (g/mol): 138.14 MDL Number: MFCD09258962 InChI Key: BGQBJWPZBBMKEI-UHFFFAOYSA-N PubChem CID: 14170517 IUPAC Name: 2-fluoro-6-methylbenzaldehyde SMILES: CC1=C(C=O)C(F)=CC=C1

PubChem CID 14170517
CAS 117752-04-2
Molecular Weight (g/mol) 138.14
MDL Number MFCD09258962
SMILES CC1=C(C=O)C(F)=CC=C1
IUPAC Name 2-fluoro-6-methylbenzaldehyde
InChI Key BGQBJWPZBBMKEI-UHFFFAOYSA-N
Molecular Formula C8H7FO
4,494
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4-Formylphenylboronic acid, 97%

CAS: 87199-17-5 Molecular Formula: C7H7BO3 Molecular Weight (g/mol): 149.94 MDL Number: MFCD00151823 InChI Key: VXWBQOJISHAKKM-UHFFFAOYSA-N Synonym: 4-formylphenyl boronic acid,4-formylbenzeneboronic acid,4-boronobenzaldehyde,boronic acid, 4-formylphenyl,boronic acid, b-4-formylphenyl,p-formylphenylboronic acid,4-dihydroxyboryl benzaldehyde,4-dihydroxyboranyl benzaldehyde,4-benzaldehyde boronic acid,4-formyl-phenylboronic acid PubChem CID: 591073 IUPAC Name: (4-formylphenyl)boronic acid SMILES: OB(O)C1=CC=C(C=O)C=C1

PubChem CID 591073
CAS 87199-17-5
Molecular Weight (g/mol) 149.94
MDL Number MFCD00151823
SMILES OB(O)C1=CC=C(C=O)C=C1
Synonym 4-formylphenyl boronic acid,4-formylbenzeneboronic acid,4-boronobenzaldehyde,boronic acid, 4-formylphenyl,boronic acid, b-4-formylphenyl,p-formylphenylboronic acid,4-dihydroxyboryl benzaldehyde,4-dihydroxyboranyl benzaldehyde,4-benzaldehyde boronic acid,4-formyl-phenylboronic acid
IUPAC Name (4-formylphenyl)boronic acid
InChI Key VXWBQOJISHAKKM-UHFFFAOYSA-N
Molecular Formula C7H7BO3
4,495

2-Thien-2-ylbenzoic acid, 97%, Thermo Scientific™

CAS: 6072-49-7 Molecular Formula: C11H8O2S Molecular Weight (g/mol): 204.243 MDL Number: MFCD04039152 InChI Key: GDSOQCSYONDNAJ-UHFFFAOYSA-N Synonym: 2-2-thienyl benzoic acid,2-thien-2-ylbenzoic acid,2-thiophen-2-yl benzoic acid,thiolbenzoic acid,2-2-thienyl-benzoic acid,2-thiophen-2-yl-benzoic acid,2-thiophene-2-yl-benzoic acid,benzoicacid, 2-2-thienyl,benzoic acid, 2-2-thienyl PubChem CID: 5105623 IUPAC Name: 2-thiophen-2-ylbenzoic acid SMILES: C1=CC=C(C(=C1)C2=CC=CS2)C(=O)O

PubChem CID 5105623
CAS 6072-49-7
Molecular Weight (g/mol) 204.243
MDL Number MFCD04039152
SMILES C1=CC=C(C(=C1)C2=CC=CS2)C(=O)O
Synonym 2-2-thienyl benzoic acid,2-thien-2-ylbenzoic acid,2-thiophen-2-yl benzoic acid,thiolbenzoic acid,2-2-thienyl-benzoic acid,2-thiophen-2-yl-benzoic acid,2-thiophene-2-yl-benzoic acid,benzoicacid, 2-2-thienyl,benzoic acid, 2-2-thienyl
IUPAC Name 2-thiophen-2-ylbenzoic acid
InChI Key GDSOQCSYONDNAJ-UHFFFAOYSA-N
Molecular Formula C11H8O2S
4,496

3-(2-Furyl)benzaldehyde, ≥97%, Thermo Scientific™

CAS: 85553-52-2 Molecular Formula: C11H8O2 Molecular Weight (g/mol): 172.18 MDL Number: MFCD03990461 InChI Key: BTAANNDAXIYWAN-UHFFFAOYSA-N Synonym: 3-2-furyl benzaldehyde,3-furan-2-yl benzaldehyde,3-furyl phenyl ketone,benzaldehyde, 3-2-furanyl,ketone, 3-furyl phenyl,3-furan-2-yl-benzaldehyde,3-furanylphenylmethanone,3-furfanylphenylmethanone,2-3-formylphenyl furan,3-2-furanyl benzaidehyde PubChem CID: 201640 IUPAC Name: 3-(furan-2-yl)benzaldehyde SMILES: O=CC1=CC=CC(=C1)C1=CC=CO1

PubChem CID 201640
CAS 85553-52-2
Molecular Weight (g/mol) 172.18
MDL Number MFCD03990461
SMILES O=CC1=CC=CC(=C1)C1=CC=CO1
Synonym 3-2-furyl benzaldehyde,3-furan-2-yl benzaldehyde,3-furyl phenyl ketone,benzaldehyde, 3-2-furanyl,ketone, 3-furyl phenyl,3-furan-2-yl-benzaldehyde,3-furanylphenylmethanone,3-furfanylphenylmethanone,2-3-formylphenyl furan,3-2-furanyl benzaidehyde
IUPAC Name 3-(furan-2-yl)benzaldehyde
InChI Key BTAANNDAXIYWAN-UHFFFAOYSA-N
Molecular Formula C11H8O2
4,497

3-(1h-1,2,4-Triazol-1-ylmethyl)benzaldehyde, 97%, Thermo Scientific™

CAS: 876316-30-2 Molecular Formula: C10H9N3O Molecular Weight (g/mol): 187.202 InChI Key: IBVURYHFXBPNCW-UHFFFAOYSA-N Synonym: 3-1h-1,2,4-triazol-1-ylmethyl benzaldehyde,benzaldehyde,3-1h-1,2,4-triazol-1-ylmethyl,3-1,2,4-triazol-1-ylmethyl benzaldehyde,3-1h-1,2,4-triazol-1-yl methyl benzaldehyde,3-1,2,4-triazolylmethyl benzaldehyde PubChem CID: 22360585 IUPAC Name: 3-(1,2,4-triazol-1-ylmethyl)benzaldehyde SMILES: C1=CC(=CC(=C1)CN2C=NC=N2)C=O

PubChem CID 22360585
CAS 876316-30-2
Molecular Weight (g/mol) 187.202
SMILES C1=CC(=CC(=C1)CN2C=NC=N2)C=O
Synonym 3-1h-1,2,4-triazol-1-ylmethyl benzaldehyde,benzaldehyde,3-1h-1,2,4-triazol-1-ylmethyl,3-1,2,4-triazol-1-ylmethyl benzaldehyde,3-1h-1,2,4-triazol-1-yl methyl benzaldehyde,3-1,2,4-triazolylmethyl benzaldehyde
IUPAC Name 3-(1,2,4-triazol-1-ylmethyl)benzaldehyde
InChI Key IBVURYHFXBPNCW-UHFFFAOYSA-N
Molecular Formula C10H9N3O
4,498
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2,5-Difluorobenzaldehyde, 98%

CAS: 2646-90-4 Molecular Formula: C7H4F2O Molecular Weight (g/mol): 142.11 MDL Number: MFCD00010327 InChI Key: VVVOJODFBWBNBI-UHFFFAOYSA-N Synonym: 2,5-difluoro benzaldehyde,2,5-difluoro-benzaldehyde,2,5-difluorobenzaldehyde,benzaldehyde, 2,5-difluoro,timtec-bb sbb006570,2,5-difluorobenzalde,pubchem1437,2,5-fluorobenzaldehyde,2,5 difluorobenzaldehyde,acmc-1cq4a PubChem CID: 137663 IUPAC Name: 2,5-difluorobenzaldehyde SMILES: C1=CC(=C(C=C1F)C=O)F

PubChem CID 137663
CAS 2646-90-4
Molecular Weight (g/mol) 142.11
MDL Number MFCD00010327
SMILES C1=CC(=C(C=C1F)C=O)F
Synonym 2,5-difluoro benzaldehyde,2,5-difluoro-benzaldehyde,2,5-difluorobenzaldehyde,benzaldehyde, 2,5-difluoro,timtec-bb sbb006570,2,5-difluorobenzalde,pubchem1437,2,5-fluorobenzaldehyde,2,5 difluorobenzaldehyde,acmc-1cq4a
IUPAC Name 2,5-difluorobenzaldehyde
InChI Key VVVOJODFBWBNBI-UHFFFAOYSA-N
Molecular Formula C7H4F2O
4,499
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3-Fluoro-2-formylbenzeneboronic acid, 95%

CAS: 871126-15-7 Molecular Formula: C7H6BFO3 Molecular Weight (g/mol): 167.93 MDL Number: MFCD10697421 InChI Key: GVHWLCYABLWGIR-UHFFFAOYSA-N Synonym: 3-fluoro-2-formylphenyl boronic acid,3-fluoro-2-formylbenzeneboronic acid,boronic acid, 3-fluoro-2-formylphenyl,acmc-209qf3,2-formyl-3-fluorophenylboranic acid,3-fluoro-2-formyl-phenyl boronic acid,3-fluoro-2-formylphenylboronic acid,boronic acid, b-3-fluoro-2-formylphenyl,contains varying amounts of anhydride PubChem CID: 53412038 IUPAC Name: (3-fluoro-2-formylphenyl)boronic acid SMILES: B(C1=C(C(=CC=C1)F)C=O)(O)O

PubChem CID 53412038
CAS 871126-15-7
Molecular Weight (g/mol) 167.93
MDL Number MFCD10697421
SMILES B(C1=C(C(=CC=C1)F)C=O)(O)O
Synonym 3-fluoro-2-formylphenyl boronic acid,3-fluoro-2-formylbenzeneboronic acid,boronic acid, 3-fluoro-2-formylphenyl,acmc-209qf3,2-formyl-3-fluorophenylboranic acid,3-fluoro-2-formyl-phenyl boronic acid,3-fluoro-2-formylphenylboronic acid,boronic acid, b-3-fluoro-2-formylphenyl,contains varying amounts of anhydride
IUPAC Name (3-fluoro-2-formylphenyl)boronic acid
InChI Key GVHWLCYABLWGIR-UHFFFAOYSA-N
Molecular Formula C7H6BFO3
4,500
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4'-n-Hexylbiphenyl-4-carboxylic acid, 99%

CAS: 59662-48-5 Molecular Formula: C19H22O2 Molecular Weight (g/mol): 282.38 MDL Number: MFCD00143232 InChI Key: ROJCBWVSXWIGAL-UHFFFAOYSA-N Synonym: 4-4-hexylphenyl benzoic acid,4-hexyl-4'-biphenylcarboxylic acid,4-hexyl-4'-carboxybiphenyl,4-n-hexylbiphenyl-4'-carboxylic acid,4'-hexyl-1,1'-biphenyl-4-carboxylic acid,pubchem9069,acmc-209mez,4'-hexylbiphenyl-4-carboxylic acid,4-hexylbiphenyl-4'-carboxylic acid,4'-hexyl-biphenyl-4-carboxylic acid PubChem CID: 13554588 IUPAC Name: 4'-hexyl-[1,1'-biphenyl]-4-carboxylic acid SMILES: CCCCCCC1=CC=C(C=C1)C1=CC=C(C=C1)C(O)=O

PubChem CID 13554588
CAS 59662-48-5
Molecular Weight (g/mol) 282.38
MDL Number MFCD00143232
SMILES CCCCCCC1=CC=C(C=C1)C1=CC=C(C=C1)C(O)=O
Synonym 4-4-hexylphenyl benzoic acid,4-hexyl-4'-biphenylcarboxylic acid,4-hexyl-4'-carboxybiphenyl,4-n-hexylbiphenyl-4'-carboxylic acid,4'-hexyl-1,1'-biphenyl-4-carboxylic acid,pubchem9069,acmc-209mez,4'-hexylbiphenyl-4-carboxylic acid,4-hexylbiphenyl-4'-carboxylic acid,4'-hexyl-biphenyl-4-carboxylic acid
IUPAC Name 4'-hexyl-[1,1'-biphenyl]-4-carboxylic acid
InChI Key ROJCBWVSXWIGAL-UHFFFAOYSA-N
Molecular Formula C19H22O2