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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5,806 – 5,820 of 159,121 results

5,806

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1-Bromo-2-chloro-4-fluorobenzene, 98%, Thermo Scientific Chemicals

CAS: 110407-59-5 Molecular Formula: C6H3BrClF Molecular Weight (g/mol): 209.442 MDL Number: MFCD00142587 InChI Key: LEFQPBAWVJEIJS-UHFFFAOYSA-N Synonym: 2-chloro-4-fluorobromobenzene,4-bromo-3-chloro-1-fluorobenzene,1-bromo-2-chloro-4-fluoro-benzene,4-bromo-3-chlorofluorobenzene,2-bromo-5-fluorochlorobenzene,benzene, 1-bromo-2-chloro-4-fluoro,pubchem3755,acmc-1bnv0,2-chloro-4-fluorobromobezene,ksc494m7f PubChem CID: 2733406 IUPAC Name: 1-bromo-2-chloro-4-fluorobenzene SMILES: C1=CC(=C(C=C1F)Cl)Br

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Specifications

PubChem CID	2733406
CAS	110407-59-5
Molecular Weight (g/mol)	209.442
MDL Number	MFCD00142587
SMILES	C1=CC(=C(C=C1F)Cl)Br
Synonym	2-chloro-4-fluorobromobenzene,4-bromo-3-chloro-1-fluorobenzene,1-bromo-2-chloro-4-fluoro-benzene,4-bromo-3-chlorofluorobenzene,2-bromo-5-fluorochlorobenzene,benzene, 1-bromo-2-chloro-4-fluoro,pubchem3755,acmc-1bnv0,2-chloro-4-fluorobromobezene,ksc494m7f
IUPAC Name	1-bromo-2-chloro-4-fluorobenzene
InChI Key	LEFQPBAWVJEIJS-UHFFFAOYSA-N
Molecular Formula	C6H3BrClF

5,807

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5-Chloro-2-methylphenol, 98%

CAS: 5306-98-9 Molecular Formula: C7H7ClO Molecular Weight (g/mol): 142.58 MDL Number: MFCD00060672 InChI Key: KKFPXGXMSBBNJI-UHFFFAOYSA-N Synonym: 5-chloro-o-cresol,5-chloro-2-cresol,o-cresol, 5-chloro,phenol, 5-chloro-2-methyl,3-chloro-6-methylphenol,2-methyl-5-chlorophenol,4-chloro-2-hydroxytoluene,5-chloro-2-methyl-phenol,phenol,5-chloro-2-methyl PubChem CID: 79192 IUPAC Name: 5-chloro-2-methylphenol SMILES: CC1=CC=C(Cl)C=C1O

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PubChem CID	79192
CAS	5306-98-9
Molecular Weight (g/mol)	142.58
MDL Number	MFCD00060672
SMILES	CC1=CC=C(Cl)C=C1O
Synonym	5-chloro-o-cresol,5-chloro-2-cresol,o-cresol, 5-chloro,phenol, 5-chloro-2-methyl,3-chloro-6-methylphenol,2-methyl-5-chlorophenol,4-chloro-2-hydroxytoluene,5-chloro-2-methyl-phenol,phenol,5-chloro-2-methyl
IUPAC Name	5-chloro-2-methylphenol
InChI Key	KKFPXGXMSBBNJI-UHFFFAOYSA-N
Molecular Formula	C7H7ClO

5,808

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2-Bromo-6-methoxyphenol, 98+%

CAS: 28165-49-3 Molecular Formula: C7H7BrO2 Molecular Weight (g/mol): 203.035 MDL Number: MFCD08146628 InChI Key: WEUFQISIJPSTBM-UHFFFAOYSA-N PubChem CID: 11019958 IUPAC Name: 2-bromo-6-methoxyphenol SMILES: COC1=C(C(=CC=C1)Br)O

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Specifications

PubChem CID	11019958
CAS	28165-49-3
Molecular Weight (g/mol)	203.035
MDL Number	MFCD08146628
SMILES	COC1=C(C(=CC=C1)Br)O
IUPAC Name	2-bromo-6-methoxyphenol
InChI Key	WEUFQISIJPSTBM-UHFFFAOYSA-N
Molecular Formula	C7H7BrO2

5,809

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2-Bromothiophenol, 97%

CAS: 6320-02-1 MDL Number: MFCD00004827

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Specifications

CAS	6320-02-1
MDL Number	MFCD00004827

5,810

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Methyl 4-iodo-3-nitrobenzoate, 99%

CAS: 89976-27-2 Molecular Formula: C8H6INO4 Molecular Weight (g/mol): 307.043 MDL Number: MFCD08064223 InChI Key: SCMBIQRYVKITCY-UHFFFAOYSA-N PubChem CID: 297884 IUPAC Name: methyl 4-iodo-3-nitrobenzoate SMILES: COC(=O)C1=CC(=C(C=C1)I)[N+](=O)[O-]

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Specifications

PubChem CID	297884
CAS	89976-27-2
Molecular Weight (g/mol)	307.043
MDL Number	MFCD08064223
SMILES	COC(=O)C1=CC(=C(C=C1)I)[N+](=O)[O-]
IUPAC Name	methyl 4-iodo-3-nitrobenzoate
InChI Key	SCMBIQRYVKITCY-UHFFFAOYSA-N
Molecular Formula	C8H6INO4

5,811

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4-Bromo-3-methoxyaniline, 97+%

CAS: 19056-40-7 Molecular Formula: C7H8BrNO Molecular Weight (g/mol): 202.05 MDL Number: MFCD05664063 InChI Key: RUTNWXBHRAIQSP-UHFFFAOYSA-N Synonym: 5-amino-2-bromoanisole,4-bromo-m-anisidine,4-bromo-3-methoxy-phenylamine,4-bromo-3-methoxy-aniline,3-methoxy-4-bromoaniline,4-bromo-3-methoxy aniline,4-bromo-3-methoxyphenylamine,benzenamine, 4-bromo-3-methoxy,4-bromo-3-methoxybenzenamine,pubchem3794 PubChem CID: 7018254 IUPAC Name: 4-bromo-3-methoxyaniline SMILES: COC1=C(Br)C=CC(N)=C1

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PubChem CID	7018254
CAS	19056-40-7
Molecular Weight (g/mol)	202.05
MDL Number	MFCD05664063
SMILES	COC1=C(Br)C=CC(N)=C1
Synonym	5-amino-2-bromoanisole,4-bromo-m-anisidine,4-bromo-3-methoxy-phenylamine,4-bromo-3-methoxy-aniline,3-methoxy-4-bromoaniline,4-bromo-3-methoxy aniline,4-bromo-3-methoxyphenylamine,benzenamine, 4-bromo-3-methoxy,4-bromo-3-methoxybenzenamine,pubchem3794
IUPAC Name	4-bromo-3-methoxyaniline
InChI Key	RUTNWXBHRAIQSP-UHFFFAOYSA-N
Molecular Formula	C7H8BrNO

5,812

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4-Chloro-3-iodophenol, 98%

CAS: 202982-72-7 Molecular Formula: C6H4ClIO Molecular Weight (g/mol): 254.451 MDL Number: MFCD00070769 InChI Key: UPIATGHEVZKVRT-UHFFFAOYSA-N Synonym: phenol, 4-chloro-3-iodo,acmc-20adn2,4-chloro-3-iodo-phenol,phenol,4-chloro-3-iodo,4-chloro-3-iodophenol PubChem CID: 22928729 IUPAC Name: 4-chloro-3-iodophenol SMILES: C1=CC(=C(C=C1O)I)Cl

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Specifications

PubChem CID	22928729
CAS	202982-72-7
Molecular Weight (g/mol)	254.451
MDL Number	MFCD00070769
SMILES	C1=CC(=C(C=C1O)I)Cl
Synonym	phenol, 4-chloro-3-iodo,acmc-20adn2,4-chloro-3-iodo-phenol,phenol,4-chloro-3-iodo,4-chloro-3-iodophenol
IUPAC Name	4-chloro-3-iodophenol
InChI Key	UPIATGHEVZKVRT-UHFFFAOYSA-N
Molecular Formula	C6H4ClIO

5,813

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2,4-Difluoro-3-methoxybenzoic acid, 98+%

CAS: 178974-97-5 Molecular Formula: C8H6F2O3 Molecular Weight (g/mol): 188.13 MDL Number: MFCD02258905 InChI Key: KWLIGHXPUYUTBH-UHFFFAOYSA-N Synonym: 2,4-difluoro-3-methoxy-benzoic acid,2,4-difluoro-3-methoxylbenzoic acid,2,4-difluoro-3-methoxy benzoic acid,pubchem4941,acmc-1cabj,3-methoxy-2,4-difluorobenzoic acid,benzoic acid,2,4-difluoro-3-methoxy PubChem CID: 3780555 IUPAC Name: 2,4-difluoro-3-methoxybenzoic acid SMILES: COC1=C(F)C=CC(C(O)=O)=C1F

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Specifications

PubChem CID	3780555
CAS	178974-97-5
Molecular Weight (g/mol)	188.13
MDL Number	MFCD02258905
SMILES	COC1=C(F)C=CC(C(O)=O)=C1F
Synonym	2,4-difluoro-3-methoxy-benzoic acid,2,4-difluoro-3-methoxylbenzoic acid,2,4-difluoro-3-methoxy benzoic acid,pubchem4941,acmc-1cabj,3-methoxy-2,4-difluorobenzoic acid,benzoic acid,2,4-difluoro-3-methoxy
IUPAC Name	2,4-difluoro-3-methoxybenzoic acid
InChI Key	KWLIGHXPUYUTBH-UHFFFAOYSA-N
Molecular Formula	C8H6F2O3

5,814

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(2-Carboxyethyl)triphenylphosphonium chloride, 98%

CAS: 36626-29-6 Molecular Formula: C21H20ClO2P Molecular Weight (g/mol): 370.81 MDL Number: MFCD00185663 InChI Key: GALLWJZTZYJVSL-UHFFFAOYSA-N Synonym: 2-carboxyethyl triphenylphosphonium chloride,2-carboxyethyl tripheylphosphonium chloride,2-carboxyethyl-triphenylphosphonium chloride,phosphonium, 2-carboxyethyl triphenyl-, chloride,2-carboxyethyl triphenylphosphanium chloride,acmc-1agne,2-carboxyethyl triphenyl phosphonium chloride,beta-carboxyethyltriphenylphosphonium chloride,2-carboxyethyl triphenyl-phosphonium chloride PubChem CID: 10270534 SMILES: [Cl-].OC(=O)CC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

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PubChem CID	10270534
CAS	36626-29-6
Molecular Weight (g/mol)	370.81
MDL Number	MFCD00185663
SMILES	[Cl-].OC(=O)CC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	2-carboxyethyl triphenylphosphonium chloride,2-carboxyethyl tripheylphosphonium chloride,2-carboxyethyl-triphenylphosphonium chloride,phosphonium, 2-carboxyethyl triphenyl-, chloride,2-carboxyethyl triphenylphosphanium chloride,acmc-1agne,2-carboxyethyl triphenyl phosphonium chloride,beta-carboxyethyltriphenylphosphonium chloride,2-carboxyethyl triphenyl-phosphonium chloride
InChI Key	GALLWJZTZYJVSL-UHFFFAOYSA-N
Molecular Formula	C21H20ClO2P

5,815

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3-Bromo-4-fluoroaniline, 98%

CAS: 656-64-4 Molecular Formula: C6H5BrFN Molecular Weight (g/mol): 190.015 MDL Number: MFCD03788559 InChI Key: KOWPUNQBGWIERF-UHFFFAOYSA-N Synonym: 3-bromo-4-fluoro aniline,benzenamine, 3-bromo-4-fluoro,3-bromo-4-fluorobenzenamine,3-bromo-4-fluorophenylamine,3-bromo-4-fluoro-aniline,3-bromo-4-fluoro-phenylamine,pubchem2924,acmc-209nrn,3-bromo-4-fluoraniline,3-bromo 4-fluoro-aniline PubChem CID: 2779286 IUPAC Name: 3-bromo-4-fluoroaniline SMILES: C1=CC(=C(C=C1N)Br)F

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Specifications

PubChem CID	2779286
CAS	656-64-4
Molecular Weight (g/mol)	190.015
MDL Number	MFCD03788559
SMILES	C1=CC(=C(C=C1N)Br)F
Synonym	3-bromo-4-fluoro aniline,benzenamine, 3-bromo-4-fluoro,3-bromo-4-fluorobenzenamine,3-bromo-4-fluorophenylamine,3-bromo-4-fluoro-aniline,3-bromo-4-fluoro-phenylamine,pubchem2924,acmc-209nrn,3-bromo-4-fluoraniline,3-bromo 4-fluoro-aniline
IUPAC Name	3-bromo-4-fluoroaniline
InChI Key	KOWPUNQBGWIERF-UHFFFAOYSA-N
Molecular Formula	C6H5BrFN

5,816

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

CAS: 69922-27-6 Molecular Formula: C8H3F4NO Molecular Weight (g/mol): 205.11 MDL Number: MFCD00673069 InChI Key: NAIKHCBDZGSGHH-UHFFFAOYSA-N PubChem CID: 2733380 IUPAC Name: 1-fluoro-2-isocyanato-4-(trifluoromethyl)benzene SMILES: FC1=CC=C(C=C1N=C=O)C(F)(F)F

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Specifications

PubChem CID	2733380
CAS	69922-27-6
Molecular Weight (g/mol)	205.11
MDL Number	MFCD00673069
SMILES	FC1=CC=C(C=C1N=C=O)C(F)(F)F
IUPAC Name	1-fluoro-2-isocyanato-4-(trifluoromethyl)benzene
InChI Key	NAIKHCBDZGSGHH-UHFFFAOYSA-N
Molecular Formula	C8H3F4NO

5,817

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5-Fluoro-2-methylanisole, 98%

CAS: 95729-22-9 Molecular Formula: C8H9FO Molecular Weight (g/mol): 140.157 MDL Number: MFCD00673008 InChI Key: CXTIUQIZWCABPV-UHFFFAOYSA-N Synonym: 5-fluoro-2-methylanisole,4-fluoro-2-methoxytoluene,4-fluoro-2-methoxy-1-methyl-benzene,pubchem2624,1-methyl-2-methoxy-4-fluorobenzene,5-fluoro-2-methylphenyl methyl ether,4-fluoranyl-2-methoxy-1-methyl-benzene,benzene, 4-fluoro-2-methoxy-1-methyl PubChem CID: 2774573 IUPAC Name: 4-fluoro-2-methoxy-1-methylbenzene SMILES: CC1=C(C=C(C=C1)F)OC

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Specifications

PubChem CID	2774573
CAS	95729-22-9
Molecular Weight (g/mol)	140.157
MDL Number	MFCD00673008
SMILES	CC1=C(C=C(C=C1)F)OC
Synonym	5-fluoro-2-methylanisole,4-fluoro-2-methoxytoluene,4-fluoro-2-methoxy-1-methyl-benzene,pubchem2624,1-methyl-2-methoxy-4-fluorobenzene,5-fluoro-2-methylphenyl methyl ether,4-fluoranyl-2-methoxy-1-methyl-benzene,benzene, 4-fluoro-2-methoxy-1-methyl
IUPAC Name	4-fluoro-2-methoxy-1-methylbenzene
InChI Key	CXTIUQIZWCABPV-UHFFFAOYSA-N
Molecular Formula	C8H9FO

5,818

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4-Bromobenzenediazonium tetrafluoroborate, 96%

CAS: 673-40-5 Molecular Formula: C6H4BBrF4N2 Molecular Weight (g/mol): 270.82 MDL Number: MFCD00011894 InChI Key: FXTCQUCYDJZGGU-UHFFFAOYSA-N Synonym: 4-bromobenzenediazonium tetrafluoroborate,acmc-209nyn,4-bromobenzene-1-diazonium; tetrafluoroboranuide,boron +3 cation; 4-bromobenzenediazonium; tetrafluoride PubChem CID: 2734810 IUPAC Name: 4-bromobenzenediazonium;tetrafluoroborate SMILES: F[B-](F)(F)F.BrC1=CC=C(C=C1)[N+]#N

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PubChem CID	2734810
CAS	673-40-5
Molecular Weight (g/mol)	270.82
MDL Number	MFCD00011894
SMILES	F[B-](F)(F)F.BrC1=CC=C(C=C1)[N+]#N
Synonym	4-bromobenzenediazonium tetrafluoroborate,acmc-209nyn,4-bromobenzene-1-diazonium; tetrafluoroboranuide,boron +3 cation; 4-bromobenzenediazonium; tetrafluoride
IUPAC Name	4-bromobenzenediazonium;tetrafluoroborate
InChI Key	FXTCQUCYDJZGGU-UHFFFAOYSA-N
Molecular Formula	C6H4BBrF4N2

5,819

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1-Bromo-2-isopropoxybenzene, 97%

CAS: 701-07-5 Molecular Formula: C9H11BrO Molecular Weight (g/mol): 215.09 MDL Number: MFCD00070759 InChI Key: MMORVPBHAHXAHH-UHFFFAOYSA-N Synonym: 1-bromo-2-isopropoxybenzene,2-2'-bromophenoxy propane,1-bromo-2-propan-2-yloxy benzene,1-bromo-2-isopropoxy benzene,2-2-bromophenoxy propane,o-bromoisopropoxybenzene,2-bromoisopropoxybenzene,1-bromo-2-1-methylethoxy benzene,2-bromophenyl isopropyl ether,pubchem3828 PubChem CID: 21925427 IUPAC Name: 1-bromo-2-propan-2-yloxybenzene SMILES: CC(C)OC1=CC=CC=C1Br

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PubChem CID	21925427
CAS	701-07-5
Molecular Weight (g/mol)	215.09
MDL Number	MFCD00070759
SMILES	CC(C)OC1=CC=CC=C1Br
Synonym	1-bromo-2-isopropoxybenzene,2-2'-bromophenoxy propane,1-bromo-2-propan-2-yloxy benzene,1-bromo-2-isopropoxy benzene,2-2-bromophenoxy propane,o-bromoisopropoxybenzene,2-bromoisopropoxybenzene,1-bromo-2-1-methylethoxy benzene,2-bromophenyl isopropyl ether,pubchem3828
IUPAC Name	1-bromo-2-propan-2-yloxybenzene
InChI Key	MMORVPBHAHXAHH-UHFFFAOYSA-N
Molecular Formula	C9H11BrO

5,820

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2',6'-Dimethylacetanilide, 97%

CAS: 2198-53-0 Molecular Formula: C10H13NO Molecular Weight (g/mol): 163.22 MDL Number: MFCD00008675 InChI Key: NRPTXWYBRKRZES-UHFFFAOYSA-N Synonym: n-2,6-dimethylphenyl acetamide,2',6'-dimethylacetanilide,2,6-dimethylacetanilide,2',6'-acetoxylidide,acetamide, n-2,6-dimethylphenyl,n-acetyl-2,6-xylidine,n-acetyl-2,6-dimethylaniline,acetanilide, 2',6'-dimethyl,unii-68gzi4j9fm,68gzi4j9fm PubChem CID: 16616 IUPAC Name: N-(2,6-dimethylphenyl)acetamide SMILES: CC1=C(C(=CC=C1)C)NC(=O)C

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Specifications

PubChem CID	16616
CAS	2198-53-0
Molecular Weight (g/mol)	163.22
MDL Number	MFCD00008675
SMILES	CC1=C(C(=CC=C1)C)NC(=O)C
Synonym	n-2,6-dimethylphenyl acetamide,2',6'-dimethylacetanilide,2,6-dimethylacetanilide,2',6'-acetoxylidide,acetamide, n-2,6-dimethylphenyl,n-acetyl-2,6-xylidine,n-acetyl-2,6-dimethylaniline,acetanilide, 2',6'-dimethyl,unii-68gzi4j9fm,68gzi4j9fm
IUPAC Name	N-(2,6-dimethylphenyl)acetamide
InChI Key	NRPTXWYBRKRZES-UHFFFAOYSA-N
Molecular Formula	C10H13NO

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