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.

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9,871 – 9,885 of 104,965 results

9,871

3-Bromo-5-nitroanisole 98.0+%, TCI America™

CAS: 16618-67-0 Molecular Formula: C7H6BrNO3 Molecular Weight (g/mol): 232.033 MDL Number: MFCD04112752 InChI Key: MEQKSFQEPDRNEQ-UHFFFAOYSA-N Synonym: 3-bromo-5-nitroanisole,3-bromo-5-nitroanisol,5-bromo-1-methoxy-3-nitrobenzene,1-bromo-3-methoxy-5-nitro-benzene,benzene, 1-bromo-3-methoxy-5-nitro,pubchem21624,acmc-209dts,3-bromo-5-methoxynitrobenzene,benzene,1-bromo-3-methoxy-5-nitro,3-methoxy-5-nitrophenyl bromide PubChem CID: 12299076 IUPAC Name: 1-bromo-3-methoxy-5-nitrobenzene SMILES: COC1=CC(=CC(=C1)[N+](=O)[O-])Br

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PubChem CID	12299076
CAS	16618-67-0
Molecular Weight (g/mol)	232.033
MDL Number	MFCD04112752
SMILES	COC1=CC(=CC(=C1)[N+](=O)[O-])Br
Synonym	3-bromo-5-nitroanisole,3-bromo-5-nitroanisol,5-bromo-1-methoxy-3-nitrobenzene,1-bromo-3-methoxy-5-nitro-benzene,benzene, 1-bromo-3-methoxy-5-nitro,pubchem21624,acmc-209dts,3-bromo-5-methoxynitrobenzene,benzene,1-bromo-3-methoxy-5-nitro,3-methoxy-5-nitrophenyl bromide
IUPAC Name	1-bromo-3-methoxy-5-nitrobenzene
InChI Key	MEQKSFQEPDRNEQ-UHFFFAOYSA-N
Molecular Formula	C7H6BrNO3

9,872

2-Bromo-5-nitroanisole 98.0+%, TCI America™

CAS: 77337-82-7 Molecular Formula: C7H6BrNO3 Molecular Weight (g/mol): 232.033 MDL Number: MFCD00041250 InChI Key: NTKADLOYTKVXQN-UHFFFAOYSA-N Synonym: 2-bromo-5-nitroanisole,4-bromo-3-methoxynitrobenzene,2-bromo-5-nitroanisol,benzene, 1-bromo-2-methoxy-4-nitro,1-bromo-2-methoxy-4-nitro-benzene,zlchem 673,pubchem2536,2-bromo 5-nitro anisole,2-bromo-5-nitro-anisole,2-bromo-5-nitro anisole PubChem CID: 101293 IUPAC Name: 1-bromo-2-methoxy-4-nitrobenzene SMILES: COC1=C(C=CC(=C1)[N+](=O)[O-])Br

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PubChem CID	101293
CAS	77337-82-7
Molecular Weight (g/mol)	232.033
MDL Number	MFCD00041250
SMILES	COC1=C(C=CC(=C1)[N+](=O)[O-])Br
Synonym	2-bromo-5-nitroanisole,4-bromo-3-methoxynitrobenzene,2-bromo-5-nitroanisol,benzene, 1-bromo-2-methoxy-4-nitro,1-bromo-2-methoxy-4-nitro-benzene,zlchem 673,pubchem2536,2-bromo 5-nitro anisole,2-bromo-5-nitro-anisole,2-bromo-5-nitro anisole
IUPAC Name	1-bromo-2-methoxy-4-nitrobenzene
InChI Key	NTKADLOYTKVXQN-UHFFFAOYSA-N
Molecular Formula	C7H6BrNO3

9,873

2-Methyl-5-nitrobenzaldehyde 98.0+%, TCI America™

CAS: 16634-91-6 Molecular Formula: C8H7NO3 Molecular Weight (g/mol): 165.148 MDL Number: MFCD03840506 InChI Key: JLFWTLNLOSUFMU-UHFFFAOYSA-N PubChem CID: 12654145 IUPAC Name: 2-methyl-5-nitrobenzaldehyde SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])C=O

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Specifications

PubChem CID	12654145
CAS	16634-91-6
Molecular Weight (g/mol)	165.148
MDL Number	MFCD03840506
SMILES	CC1=C(C=C(C=C1)[N+](=O)[O-])C=O
IUPAC Name	2-methyl-5-nitrobenzaldehyde
InChI Key	JLFWTLNLOSUFMU-UHFFFAOYSA-N
Molecular Formula	C8H7NO3

9,874

4-Methoxy-3-nitrotoluene 98.0+%, TCI America™

CAS: 119-10-8 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.16 MDL Number: MFCD00024540 InChI Key: LGNMURXRPLMVJI-UHFFFAOYSA-N Synonym: 1-Methoxy-4-methyl-2-nitrobenzene, 4-Methyl-2-nitroanisole PubChem CID: 67058 IUPAC Name: 1-methoxy-4-methyl-2-nitrobenzene SMILES: COC1=CC=C(C)C=C1[N+]([O-])=O

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Specifications

PubChem CID	67058
CAS	119-10-8
Molecular Weight (g/mol)	167.16
MDL Number	MFCD00024540
SMILES	COC1=CC=C(C)C=C1[N+]([O-])=O
Synonym	1-Methoxy-4-methyl-2-nitrobenzene, 4-Methyl-2-nitroanisole
IUPAC Name	1-methoxy-4-methyl-2-nitrobenzene
InChI Key	LGNMURXRPLMVJI-UHFFFAOYSA-N
Molecular Formula	C8H9NO3

9,875

4-Chloro-3-nitrobenzaldehyde 95.0+%, TCI America™

CAS: 16588-34-4 Molecular Formula: C7H4ClNO3 Molecular Weight (g/mol): 185.56 MDL Number: MFCD00007078 InChI Key: HETBKLHJEWXWBM-UHFFFAOYSA-N Synonym: 3-nitro-4-chlorobenzaldehyde,benzaldehyde, 4-chloro-3-nitro,chembl51664,4-chloro-3-nitro-benzaldehyde,pubchem14274,acmc-1c7bn,3nitro-4-chlorobenzaldehyde,asischem r36965,dsstox_cid_24846,dsstox_rid_80526 PubChem CID: 85505 IUPAC Name: 4-chloro-3-nitrobenzaldehyde SMILES: [O-][N+](=O)C1=CC(C=O)=CC=C1Cl

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Specifications

PubChem CID	85505
CAS	16588-34-4
Molecular Weight (g/mol)	185.56
MDL Number	MFCD00007078
SMILES	[O-][N+](=O)C1=CC(C=O)=CC=C1Cl
Synonym	3-nitro-4-chlorobenzaldehyde,benzaldehyde, 4-chloro-3-nitro,chembl51664,4-chloro-3-nitro-benzaldehyde,pubchem14274,acmc-1c7bn,3nitro-4-chlorobenzaldehyde,asischem r36965,dsstox_cid_24846,dsstox_rid_80526
IUPAC Name	4-chloro-3-nitrobenzaldehyde
InChI Key	HETBKLHJEWXWBM-UHFFFAOYSA-N
Molecular Formula	C7H4ClNO3

9,876

1,2-Dimethoxy-4-nitrobenzene 99.0+%, TCI America™

CAS: 709-09-1 Molecular Formula: C8H9NO4 Molecular Weight (g/mol): 183.16 MDL Number: MFCD00007238 InChI Key: YFWBUVZWCBFSQN-UHFFFAOYSA-N Synonym: 3,4-dimethoxynitrobenzene,4-nitroveratrole,benzene, 1,2-dimethoxy-4-nitro,4-nitrcveratrole,4-nitro-1,2-dimethoxybenzene,benzene,2-dimethoxy-4-nitro,1,2-dimethoxy-4-nitrobenzol,3,4-dimethoxylnitrobenzene,3,4-dimethoxy-1-nitrobenzene PubChem CID: 69728 IUPAC Name: 1,2-dimethoxy-4-nitrobenzene SMILES: COC1=CC=C(C=C1OC)[N+]([O-])=O

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PubChem CID	69728
CAS	709-09-1
Molecular Weight (g/mol)	183.16
MDL Number	MFCD00007238
SMILES	COC1=CC=C(C=C1OC)[N+]([O-])=O
Synonym	3,4-dimethoxynitrobenzene,4-nitroveratrole,benzene, 1,2-dimethoxy-4-nitro,4-nitrcveratrole,4-nitro-1,2-dimethoxybenzene,benzene,2-dimethoxy-4-nitro,1,2-dimethoxy-4-nitrobenzol,3,4-dimethoxylnitrobenzene,3,4-dimethoxy-1-nitrobenzene
IUPAC Name	1,2-dimethoxy-4-nitrobenzene
InChI Key	YFWBUVZWCBFSQN-UHFFFAOYSA-N
Molecular Formula	C8H9NO4

9,877

2-Bromo-4-nitroanisole 98.0+%, TCI America™

CAS: 5197-28-4 Molecular Formula: C7H6BrNO3 Molecular Weight (g/mol): 232.03 MDL Number: MFCD00041242 InChI Key: JMUDXQVNBZCQRF-UHFFFAOYSA-N Synonym: 2-bromo-4-nitroanisole,3-bromo-4-methoxynitrobenzene,anisole, 2-bromo-4-nitro,benzene, 2-bromo-1-methoxy-4-nitro,2-bromo-1-methoxy-4-nitro-benzene,pubchem4133,2-bromo4-nitroanisole,4-nitro-2-bromanisol,acmc-1awkm,2-bromo-4-nitro anisole PubChem CID: 78870 IUPAC Name: 2-bromo-1-methoxy-4-nitrobenzene SMILES: COC1=CC=C(C=C1Br)[N+]([O-])=O

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Specifications

PubChem CID	78870
CAS	5197-28-4
Molecular Weight (g/mol)	232.03
MDL Number	MFCD00041242
SMILES	COC1=CC=C(C=C1Br)[N+]([O-])=O
Synonym	2-bromo-4-nitroanisole,3-bromo-4-methoxynitrobenzene,anisole, 2-bromo-4-nitro,benzene, 2-bromo-1-methoxy-4-nitro,2-bromo-1-methoxy-4-nitro-benzene,pubchem4133,2-bromo4-nitroanisole,4-nitro-2-bromanisol,acmc-1awkm,2-bromo-4-nitro anisole
IUPAC Name	2-bromo-1-methoxy-4-nitrobenzene
InChI Key	JMUDXQVNBZCQRF-UHFFFAOYSA-N
Molecular Formula	C7H6BrNO3

9,878

4-tert-Butyl-3-methoxy-2,6-dinitrotoluene 99.0+%, TCI America™

CAS: 83-66-9 Molecular Formula: C12H16N2O5 Molecular Weight (g/mol): 268.269 MDL Number: MFCD00024268 InChI Key: SUAUILGSCPYJCS-UHFFFAOYSA-N Synonym: 6-tert-Butyl-3-methyl-2,4-dinitroanisole PubChem CID: 6753 ChEBI: CHEBI:82495 IUPAC Name: 1-tert-butyl-2-methoxy-4-methyl-3,5-dinitrobenzene SMILES: CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C(C)(C)C)[N+](=O)[O-]

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PubChem CID	6753
CAS	83-66-9
Molecular Weight (g/mol)	268.269
ChEBI	CHEBI:82495
MDL Number	MFCD00024268
SMILES	CC1=C(C=C(C(=C1[N+](=O)[O-])OC)C(C)(C)C)[N+](=O)[O-]
Synonym	6-tert-Butyl-3-methyl-2,4-dinitroanisole
IUPAC Name	1-tert-butyl-2-methoxy-4-methyl-3,5-dinitrobenzene
InChI Key	SUAUILGSCPYJCS-UHFFFAOYSA-N
Molecular Formula	C12H16N2O5

9,879

5-Nitroguaiacol Sodium Salt 98.0+%, TCI America™

CAS: 67233-85-6 Molecular Formula: C7H6NNaO4 Molecular Weight (g/mol): 191.12 MDL Number: MFCD00070570 InChI Key: KBRKFTKQRMYINW-UHFFFAOYSA-M Synonym: 2-Methoxy-5-nitrophenol Sodium Salt PubChem CID: 3017748 IUPAC Name: sodium 2-methoxy-5-nitrobenzen-1-olate SMILES: [Na+].COC1=CC=C(C=C1[O-])[N+]([O-])=O

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Specifications

PubChem CID	3017748
CAS	67233-85-6
Molecular Weight (g/mol)	191.12
MDL Number	MFCD00070570
SMILES	[Na+].COC1=CC=C(C=C1[O-])[N+]([O-])=O
Synonym	2-Methoxy-5-nitrophenol Sodium Salt
IUPAC Name	sodium 2-methoxy-5-nitrobenzen-1-olate
InChI Key	KBRKFTKQRMYINW-UHFFFAOYSA-M
Molecular Formula	C7H6NNaO4

9,880

4-Chloro-3-nitroanisole 98.0+%, TCI America™

CAS: 10298-80-3 Molecular Formula: C7H6ClNO3 Molecular Weight (g/mol): 187.579 MDL Number: MFCD00007077 InChI Key: HISHUMDTGXICEZ-UHFFFAOYSA-N Synonym: 4-chloro-3-nitroanisole,2-chloro-5-methoxynitrobenzene,anisole, 4-chloro-3-nitro,benzene, 1-chloro-4-methoxy-2-nitro,1-chloro-4-methoxy-2-nitro-benzene,4-methoxy-2-nitrochlorobenzene,pubchem2627,4-chloro-3-nitroanisol,3-nitro-4-chloroanisole,4-chloro-3-nitro-anisol PubChem CID: 25140 IUPAC Name: 1-chloro-4-methoxy-2-nitrobenzene SMILES: COC1=CC(=C(C=C1)Cl)[N+](=O)[O-]

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PubChem CID	25140
CAS	10298-80-3
Molecular Weight (g/mol)	187.579
MDL Number	MFCD00007077
SMILES	COC1=CC(=C(C=C1)Cl)[N+](=O)[O-]
Synonym	4-chloro-3-nitroanisole,2-chloro-5-methoxynitrobenzene,anisole, 4-chloro-3-nitro,benzene, 1-chloro-4-methoxy-2-nitro,1-chloro-4-methoxy-2-nitro-benzene,4-methoxy-2-nitrochlorobenzene,pubchem2627,4-chloro-3-nitroanisol,3-nitro-4-chloroanisole,4-chloro-3-nitro-anisol
IUPAC Name	1-chloro-4-methoxy-2-nitrobenzene
InChI Key	HISHUMDTGXICEZ-UHFFFAOYSA-N
Molecular Formula	C7H6ClNO3

9,881

3,4-Dihydroxy-5-nitrobenzaldehyde 98.0+%, TCI America™

CAS: 116313-85-0 Molecular Formula: C7H5NO5 Molecular Weight (g/mol): 183.119 MDL Number: MFCD00871897 InChI Key: BBFJODMCHICIAA-UHFFFAOYSA-N PubChem CID: 5748957 SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)O)C=O

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Specifications

PubChem CID	5748957
CAS	116313-85-0
Molecular Weight (g/mol)	183.119
MDL Number	MFCD00871897
SMILES	C1=C(C=C(C(=C1[N+](=O)[O-])O)O)C=O
InChI Key	BBFJODMCHICIAA-UHFFFAOYSA-N
Molecular Formula	C7H5NO5

9,882

2-Chloro-5-nitrobenzaldehyde 96.0+%, TCI America™

CAS: 6361-21-3 Molecular Formula: C7H4ClNO3 Molecular Weight (g/mol): 185.56 MDL Number: MFCD00007293 InChI Key: VFVHWCKUHAEDMY-UHFFFAOYSA-N Synonym: benzaldehyde, 2-chloro-5-nitro,3-nitro-6-chlorobenzaldehyde,2-chloro-5-nitro-benzaldehyde,unii-pf4ill0i3h,pf4ill0i3h,2-chlor-5-nitrobenzaldehyd,pubchem7375,wln: wnr dg cvh,chloro-5-nitrobenzaldehyde,asischem r37046 PubChem CID: 72933 IUPAC Name: 2-chloro-5-nitrobenzaldehyde SMILES: [O-][N+](=O)C1=CC=C(Cl)C(C=O)=C1

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PubChem CID	72933
CAS	6361-21-3
Molecular Weight (g/mol)	185.56
MDL Number	MFCD00007293
SMILES	[O-][N+](=O)C1=CC=C(Cl)C(C=O)=C1
Synonym	benzaldehyde, 2-chloro-5-nitro,3-nitro-6-chlorobenzaldehyde,2-chloro-5-nitro-benzaldehyde,unii-pf4ill0i3h,pf4ill0i3h,2-chlor-5-nitrobenzaldehyd,pubchem7375,wln: wnr dg cvh,chloro-5-nitrobenzaldehyde,asischem r37046
IUPAC Name	2-chloro-5-nitrobenzaldehyde
InChI Key	VFVHWCKUHAEDMY-UHFFFAOYSA-N
Molecular Formula	C7H4ClNO3

9,883

2-Bromo-4-methoxy-6-nitrophenol 98.0+%, TCI America™

CAS: 115929-59-4 Molecular Formula: C7H6BrNO4 Molecular Weight (g/mol): 248.032 MDL Number: MFCD06797984 InChI Key: GAVVLRJHVWIDPK-UHFFFAOYSA-N PubChem CID: 11265140 IUPAC Name: 2-bromo-4-methoxy-6-nitrophenol SMILES: COC1=CC(=C(C(=C1)[N+](=O)[O-])O)Br

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Specifications

PubChem CID	11265140
CAS	115929-59-4
Molecular Weight (g/mol)	248.032
MDL Number	MFCD06797984
SMILES	COC1=CC(=C(C(=C1)[N+](=O)[O-])O)Br
IUPAC Name	2-bromo-4-methoxy-6-nitrophenol
InChI Key	GAVVLRJHVWIDPK-UHFFFAOYSA-N
Molecular Formula	C7H6BrNO4

9,884

4-Methoxy-2-nitrophenol 98.0+%, TCI America™

CAS: 1568-70-3 Molecular Formula: C7H7NO4 Molecular Weight (g/mol): 169.136 MDL Number: MFCD00024247 InChI Key: YBUGOACXDPDUIR-UHFFFAOYSA-N Synonym: phenol, 4-methoxy-2-nitro,2-nitro-4-methoxyphenol,4-hydroxy-3-nitroanisole,4-methoxy-2-nitro-phenol,zlchem 182,pubchem16829,acmc-1c0rf,ksc494i1t,4-methoxy-2-nitrophenol PubChem CID: 15285 IUPAC Name: 4-methoxy-2-nitrophenol SMILES: COC1=CC(=C(C=C1)O)[N+](=O)[O-]

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Specifications

PubChem CID	15285
CAS	1568-70-3
Molecular Weight (g/mol)	169.136
MDL Number	MFCD00024247
SMILES	COC1=CC(=C(C=C1)O)[N+](=O)[O-]
Synonym	phenol, 4-methoxy-2-nitro,2-nitro-4-methoxyphenol,4-hydroxy-3-nitroanisole,4-methoxy-2-nitro-phenol,zlchem 182,pubchem16829,acmc-1c0rf,ksc494i1t,4-methoxy-2-nitrophenol
IUPAC Name	4-methoxy-2-nitrophenol
InChI Key	YBUGOACXDPDUIR-UHFFFAOYSA-N
Molecular Formula	C7H7NO4

9,885

3-Hydroxy-4-nitrobenzaldehyde 97.0+%, TCI America™

CAS: 704-13-2 Molecular Formula: C7H5NO4 Molecular Weight (g/mol): 167.12 MDL Number: MFCD00007109 InChI Key: AUBBVPIQUDFRQI-UHFFFAOYSA-N Synonym: benzaldehyde, 3-hydroxy-4-nitro,3-hydroxy-4-nitro-benzaldehyde,4-nitro-3-hydroxybenzaldehyde,3-formyl-6-nitrophenol,acmc-1bm06,ksc495a6r,3-hydroxy-4-nitro benzaldehyde,3-hydroxy-4-nitrobenzaldehyde PubChem CID: 69712 IUPAC Name: 3-hydroxy-4-nitrobenzaldehyde SMILES: OC1=CC(C=O)=CC=C1[N+]([O-])=O

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Specifications

PubChem CID	69712
CAS	704-13-2
Molecular Weight (g/mol)	167.12
MDL Number	MFCD00007109
SMILES	OC1=CC(C=O)=CC=C1[N+]([O-])=O
Synonym	benzaldehyde, 3-hydroxy-4-nitro,3-hydroxy-4-nitro-benzaldehyde,4-nitro-3-hydroxybenzaldehyde,3-formyl-6-nitrophenol,acmc-1bm06,ksc495a6r,3-hydroxy-4-nitro benzaldehyde,3-hydroxy-4-nitrobenzaldehyde
IUPAC Name	3-hydroxy-4-nitrobenzaldehyde
InChI Key	AUBBVPIQUDFRQI-UHFFFAOYSA-N
Molecular Formula	C7H5NO4

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