Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.

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5,896 – 5,910 of 119,767 results

5,896

5'-Chloro-3-hydroxy-2'-methyl-2-naphthanilide 96.0+%, TCI America™

CAS: 135-63-7 Molecular Formula: C18H14ClNO2 Molecular Weight (g/mol): 311.765 MDL Number: MFCD00021636 InChI Key: XZOACPDZZYNJER-UHFFFAOYSA-N Synonym: N-(5-Chloro-o-tolyl)-3-hydroxy-2-naphthamide, Naphthol AS-KB, Azoic Coupling Component 21, 5′C-Chloro-N-(3-hydroxy-2-naphthoyl)-o-toluidine PubChem CID: 67275 IUPAC Name: N-(5-chloro-2-methylphenyl)-3-hydroxynaphthalene-2-carboxamide SMILES: CC1=C(C=C(C=C1)Cl)NC(=O)C2=CC3=CC=CC=C3C=C2O

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Specifications

PubChem CID	67275
CAS	135-63-7
Molecular Weight (g/mol)	311.765
MDL Number	MFCD00021636
SMILES	CC1=C(C=C(C=C1)Cl)NC(=O)C2=CC3=CC=CC=C3C=C2O
Synonym	N-(5-Chloro-o-tolyl)-3-hydroxy-2-naphthamide, Naphthol AS-KB, Azoic Coupling Component 21, 5′C-Chloro-N-(3-hydroxy-2-naphthoyl)-o-toluidine
IUPAC Name	N-(5-chloro-2-methylphenyl)-3-hydroxynaphthalene-2-carboxamide
InChI Key	XZOACPDZZYNJER-UHFFFAOYSA-N
Molecular Formula	C18H14ClNO2

5,897

2-Chloro-5-methoxyaniline 98.0+%, TCI America™

CAS: 2401-24-3 Molecular Formula: C7H8ClNO Molecular Weight (g/mol): 157.597 MDL Number: MFCD00047830 InChI Key: GBOUQGUQUUPGLO-UHFFFAOYSA-N Synonym: 6-chloro-m-anisidine,3-amino-4-chloroanisole,benzenamine, 2-chloro-5-methoxy,2-chloro-5-methoxy-aniline,6-chloro-m-anisidine hydrochloride,2-chloro-5-methoxy-phenylamine,2-chloro-5-methoxybenzenamine hydrochloride,6-chloro-meta-anisidine hydrochloride,2-chloro-5-methoxyanilinehydrochloride,timtec-bb sbb008038 PubChem CID: 75460 IUPAC Name: 2-chloro-5-methoxyaniline SMILES: COC1=CC(=C(C=C1)Cl)N

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PubChem CID	75460
CAS	2401-24-3
Molecular Weight (g/mol)	157.597
MDL Number	MFCD00047830
SMILES	COC1=CC(=C(C=C1)Cl)N
Synonym	6-chloro-m-anisidine,3-amino-4-chloroanisole,benzenamine, 2-chloro-5-methoxy,2-chloro-5-methoxy-aniline,6-chloro-m-anisidine hydrochloride,2-chloro-5-methoxy-phenylamine,2-chloro-5-methoxybenzenamine hydrochloride,6-chloro-meta-anisidine hydrochloride,2-chloro-5-methoxyanilinehydrochloride,timtec-bb sbb008038
IUPAC Name	2-chloro-5-methoxyaniline
InChI Key	GBOUQGUQUUPGLO-UHFFFAOYSA-N
Molecular Formula	C7H8ClNO

5,898

2,3,4,5-Tetrachlorobenzoic Acid 97.0+%, TCI America™

CAS: 50-74-8 Molecular Formula: C7H2Cl4O2 Molecular Weight (g/mol): 259.89 MDL Number: MFCD00061126 InChI Key: FUXMTEKFGUWSNC-UHFFFAOYSA-N PubChem CID: 5782 IUPAC Name: 2,3,4,5-tetrachlorobenzoic acid SMILES: OC(=O)C1=CC(Cl)=C(Cl)C(Cl)=C1Cl

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Specifications

PubChem CID	5782
CAS	50-74-8
Molecular Weight (g/mol)	259.89
MDL Number	MFCD00061126
SMILES	OC(=O)C1=CC(Cl)=C(Cl)C(Cl)=C1Cl
IUPAC Name	2,3,4,5-tetrachlorobenzoic acid
InChI Key	FUXMTEKFGUWSNC-UHFFFAOYSA-N
Molecular Formula	C7H2Cl4O2

5,899

2,3,4-Trifluorobenzoyl Chloride 98.0+%, TCI America™

CAS: 157373-08-5 Molecular Formula: C7H2ClF3O Molecular Weight (g/mol): 194.537 MDL Number: MFCD00075078 InChI Key: NXRQXCFBZGIRGN-UHFFFAOYSA-N Synonym: 2,3,4-trifluorobenzoylchloride,2,3,4-trifluoro-benzoyl chloride,benzoyl chloride, 2,3,4-trifluoro,benzoyl chloride, 2,3,4-trifluoro-9ci,trifluorobenzoylchloride,trifluorobenzoyl chloride,intermediates-zcf02190,acmc-209dg2,2,3,4-trifluorobenzoyl chloride PubChem CID: 2734022 IUPAC Name: 2,3,4-trifluorobenzoyl chloride SMILES: C1=CC(=C(C(=C1C(=O)Cl)F)F)F

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Specifications

PubChem CID	2734022
CAS	157373-08-5
Molecular Weight (g/mol)	194.537
MDL Number	MFCD00075078
SMILES	C1=CC(=C(C(=C1C(=O)Cl)F)F)F
Synonym	2,3,4-trifluorobenzoylchloride,2,3,4-trifluoro-benzoyl chloride,benzoyl chloride, 2,3,4-trifluoro,benzoyl chloride, 2,3,4-trifluoro-9ci,trifluorobenzoylchloride,trifluorobenzoyl chloride,intermediates-zcf02190,acmc-209dg2,2,3,4-trifluorobenzoyl chloride
IUPAC Name	2,3,4-trifluorobenzoyl chloride
InChI Key	NXRQXCFBZGIRGN-UHFFFAOYSA-N
Molecular Formula	C7H2ClF3O

5,900

3'-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)acetanilide 98.0+%, TCI America™

CAS: 480424-93-9 Molecular Formula: C14H20BNO3 Molecular Weight (g/mol): 261.128 MDL Number: MFCD03789261 InChI Key: CZFSGYCLOCCASM-UHFFFAOYSA-N Synonym: 3-Acetamidophenylboronic Acid Pinacol Ester, 2-(3-Acetamidophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane PubChem CID: 2773989 IUPAC Name: N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)NC(=O)C

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Specifications

PubChem CID	2773989
CAS	480424-93-9
Molecular Weight (g/mol)	261.128
MDL Number	MFCD03789261
SMILES	B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)NC(=O)C
Synonym	3-Acetamidophenylboronic Acid Pinacol Ester, 2-(3-Acetamidophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
IUPAC Name	N-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]acetamide
InChI Key	CZFSGYCLOCCASM-UHFFFAOYSA-N
Molecular Formula	C14H20BNO3

5,901

3,4,5-Trifluorobenzaldehyde 98.0+%, TCI America™

CAS: 132123-54-7 Molecular Formula: C7H3F3O Molecular Weight (g/mol): 160.10 MDL Number: MFCD00083523 InChI Key: NLAVHUUABUFSIG-UHFFFAOYSA-N Synonym: benzaldehyde, 3,4,5-trifluoro,3,4,5-trifluoro-benzaldehyde,3,4,5-ttrifluorobenzaldehyde,acmc-209bon,intermediates-zcf02014,3,4,5-triflourobenzaldehyde,3,4,5-trifluorobrnzaldehyde,ksc182i0f,3,4,5-trifluorobenzaldehyde,benzaldehyde, 3,4,5-trifluoro-9ci PubChem CID: 2776954 IUPAC Name: 3,4,5-trifluorobenzaldehyde SMILES: FC1=CC(C=O)=CC(F)=C1F

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PubChem CID	2776954
CAS	132123-54-7
Molecular Weight (g/mol)	160.10
MDL Number	MFCD00083523
SMILES	FC1=CC(C=O)=CC(F)=C1F
Synonym	benzaldehyde, 3,4,5-trifluoro,3,4,5-trifluoro-benzaldehyde,3,4,5-ttrifluorobenzaldehyde,acmc-209bon,intermediates-zcf02014,3,4,5-triflourobenzaldehyde,3,4,5-trifluorobrnzaldehyde,ksc182i0f,3,4,5-trifluorobenzaldehyde,benzaldehyde, 3,4,5-trifluoro-9ci
IUPAC Name	3,4,5-trifluorobenzaldehyde
InChI Key	NLAVHUUABUFSIG-UHFFFAOYSA-N
Molecular Formula	C7H3F3O

5,902

Methyl Salicylate 99.0+%, TCI America™

CAS: 119-36-8 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002214 InChI Key: OSWPMRLSEDHDFF-UHFFFAOYSA-N Synonym: methyl salicylate,wintergreen oil,gaultheria oil,betula oil,teaberry oil,sweet birch oil,oil of wintergreen,analgit,spicewood oil,2-hydroxybenzoic acid methyl ester PubChem CID: 4133 ChEBI: CHEBI:31832 IUPAC Name: methyl 2-hydroxybenzoate SMILES: COC(=O)C1=CC=CC=C1O

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Specifications

PubChem CID	4133
CAS	119-36-8
Molecular Weight (g/mol)	152.149
ChEBI	CHEBI:31832
MDL Number	MFCD00002214
SMILES	COC(=O)C1=CC=CC=C1O
Synonym	methyl salicylate,wintergreen oil,gaultheria oil,betula oil,teaberry oil,sweet birch oil,oil of wintergreen,analgit,spicewood oil,2-hydroxybenzoic acid methyl ester
IUPAC Name	methyl 2-hydroxybenzoate
InChI Key	OSWPMRLSEDHDFF-UHFFFAOYSA-N
Molecular Formula	C8H8O3

5,903

1-Bromo-2,4-dichlorobenzene 98.0+%, TCI America™

CAS: 1193-72-2 Molecular Formula: C6H3BrCl2 Molecular Weight (g/mol): 225.894 MDL Number: MFCD00018333 InChI Key: ISHYFWKKWKXXPL-UHFFFAOYSA-N Synonym: 2,4-dichlorobromobenzene,bromo 2--4-dichlorobenzene,1-bromo-2,4-dichloro-benzene,benzene, 1-bromo-2,4-dichloro,pubchem3608,2,4-dichlorobromobenze,2,4-dichloro-bromobenzene,acmc-209a2k,2,4-dichloro-1-bromobenzene,ksc490m9l PubChem CID: 70947 IUPAC Name: 1-bromo-2,4-dichlorobenzene SMILES: C1=CC(=C(C=C1Cl)Cl)Br

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PubChem CID	70947
CAS	1193-72-2
Molecular Weight (g/mol)	225.894
MDL Number	MFCD00018333
SMILES	C1=CC(=C(C=C1Cl)Cl)Br
Synonym	2,4-dichlorobromobenzene,bromo 2--4-dichlorobenzene,1-bromo-2,4-dichloro-benzene,benzene, 1-bromo-2,4-dichloro,pubchem3608,2,4-dichlorobromobenze,2,4-dichloro-bromobenzene,acmc-209a2k,2,4-dichloro-1-bromobenzene,ksc490m9l
IUPAC Name	1-bromo-2,4-dichlorobenzene
InChI Key	ISHYFWKKWKXXPL-UHFFFAOYSA-N
Molecular Formula	C6H3BrCl2

5,904

alpha,alpha,alpha',alpha',4,5-Hexabromo-o-xylene 98.0+%, TCI America™

CAS: 13209-20-6 Molecular Formula: C8H4Br6 Molecular Weight (g/mol): 579.544 MDL Number: MFCD00191445 InChI Key: QPLVNMIEWOGDBY-UHFFFAOYSA-N PubChem CID: 12186451 IUPAC Name: 1,2-dibromo-4,5-bis(dibromomethyl)benzene SMILES: C1=C(C(=CC(=C1Br)Br)C(Br)Br)C(Br)Br

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Specifications

PubChem CID	12186451
CAS	13209-20-6
Molecular Weight (g/mol)	579.544
MDL Number	MFCD00191445
SMILES	C1=C(C(=CC(=C1Br)Br)C(Br)Br)C(Br)Br
IUPAC Name	1,2-dibromo-4,5-bis(dibromomethyl)benzene
InChI Key	QPLVNMIEWOGDBY-UHFFFAOYSA-N
Molecular Formula	C8H4Br6

5,905

(R)-(+)-1-(4-Bromophenyl)ethylamine 98.0+%, TCI America™

CAS: 45791-36-4 Molecular Formula: C8H10BrN Molecular Weight (g/mol): 200.079 MDL Number: MFCD00066025 InChI Key: SOZMSEPDYJGBEK-ZCFIWIBFSA-N Synonym: r-1-4-bromophenyl ethylamine,r-+-1-4-bromophenyl ethylamine,r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethan-1-amine,r-1-4-bromophenyl-ethylamine,r-4-bromo-alpha-methylbenzylamine,r-+-4-bromo a-methylbenzylamine,p-bromo-a-methylbenzylamine,pubchem14234 PubChem CID: 853000 IUPAC Name: (1R)-1-(4-bromophenyl)ethanamine SMILES: CC(C1=CC=C(C=C1)Br)N

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PubChem CID	853000
CAS	45791-36-4
Molecular Weight (g/mol)	200.079
MDL Number	MFCD00066025
SMILES	CC(C1=CC=C(C=C1)Br)N
Synonym	r-1-4-bromophenyl ethylamine,r-+-1-4-bromophenyl ethylamine,r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethanamine,1r-1-4-bromophenyl ethan-1-amine,r-1-4-bromophenyl-ethylamine,r-4-bromo-alpha-methylbenzylamine,r-+-4-bromo a-methylbenzylamine,p-bromo-a-methylbenzylamine,pubchem14234
IUPAC Name	(1R)-1-(4-bromophenyl)ethanamine
InChI Key	SOZMSEPDYJGBEK-ZCFIWIBFSA-N
Molecular Formula	C8H10BrN

5,906

1-Bromo-3-hexylbenzene 98.0+%, TCI America™

CAS: 38409-59-5 Molecular Formula: C12H17Br Molecular Weight (g/mol): 241.172 MDL Number: MFCD09909567 InChI Key: HZUVRCRPECDFAT-UHFFFAOYSA-N Synonym: 1-bromo-3-n-hexylbenzene,1-bromo-3-hexyl-benzene,3-hexylbromobenzene,3-n-hexyl bromobenzene,#,benzene, 1-bromo-3-hexyl PubChem CID: 563022 IUPAC Name: 1-bromo-3-hexylbenzene SMILES: CCCCCCC1=CC(=CC=C1)Br

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PubChem CID	563022
CAS	38409-59-5
Molecular Weight (g/mol)	241.172
MDL Number	MFCD09909567
SMILES	CCCCCCC1=CC(=CC=C1)Br
Synonym	1-bromo-3-n-hexylbenzene,1-bromo-3-hexyl-benzene,3-hexylbromobenzene,3-n-hexyl bromobenzene,#,benzene, 1-bromo-3-hexyl
IUPAC Name	1-bromo-3-hexylbenzene
InChI Key	HZUVRCRPECDFAT-UHFFFAOYSA-N
Molecular Formula	C12H17Br

5,907

1-Bromo-4-(phenylethynyl)benzene 98.0+%, TCI America™

CAS: 13667-12-4 Molecular Formula: C14H9Br Molecular Weight (g/mol): 257.13 MDL Number: MFCD01596910 InChI Key: XLHCHVUFUPJPEO-UHFFFAOYSA-N Synonym: 1-(4-Bromophenyl)-2-phenylacetylene PubChem CID: 290888 IUPAC Name: 1-bromo-4-(2-phenylethynyl)benzene SMILES: C1=CC=C(C=C1)C#CC2=CC=C(C=C2)Br

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Specifications

PubChem CID	290888
CAS	13667-12-4
Molecular Weight (g/mol)	257.13
MDL Number	MFCD01596910
SMILES	C1=CC=C(C=C1)C#CC2=CC=C(C=C2)Br
Synonym	1-(4-Bromophenyl)-2-phenylacetylene
IUPAC Name	1-bromo-4-(2-phenylethynyl)benzene
InChI Key	XLHCHVUFUPJPEO-UHFFFAOYSA-N
Molecular Formula	C14H9Br

5,908

1,2,4,5-Tetrabromobenzene 97.0+%, TCI America™

CAS: 636-28-2 Molecular Formula: C6H2Br4 Molecular Weight (g/mol): 393.70 MDL Number: MFCD00000063 InChI Key: QCKHVNQHBOGZER-UHFFFAOYSA-N PubChem CID: 12486 IUPAC Name: 1,2,4,5-tetrabromobenzene SMILES: BrC1=CC(Br)=C(Br)C=C1Br

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PubChem CID	12486
CAS	636-28-2
Molecular Weight (g/mol)	393.70
MDL Number	MFCD00000063
SMILES	BrC1=CC(Br)=C(Br)C=C1Br
IUPAC Name	1,2,4,5-tetrabromobenzene
InChI Key	QCKHVNQHBOGZER-UHFFFAOYSA-N
Molecular Formula	C6H2Br4

5,909

Mesityl Bromide 99.0+%, TCI America™

CAS: 576-83-0 Molecular Formula: C9H11Br Molecular Weight (g/mol): 199.091 MDL Number: MFCD00000073 InChI Key: RRTLQRYOJOSPEA-UHFFFAOYSA-N Synonym: 2-bromomesitylene,2,4,6-trimethylbromobenzene,mesityl bromide,bromomesitylene,benzene, 2-bromo-1,3,5-trimethyl,2,4,6-trimethybromombenzene,mesitylene, 2-bromo,2,4,6-trimethylphenyl bromide,1-bromo-2,4,6-trimethylbenzene,2-bromo-1,3,5-trimethyl-benzene PubChem CID: 68473 IUPAC Name: 2-bromo-1,3,5-trimethylbenzene SMILES: CC1=CC(=C(C(=C1)C)Br)C

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PubChem CID	68473
CAS	576-83-0
Molecular Weight (g/mol)	199.091
MDL Number	MFCD00000073
SMILES	CC1=CC(=C(C(=C1)C)Br)C
Synonym	2-bromomesitylene,2,4,6-trimethylbromobenzene,mesityl bromide,bromomesitylene,benzene, 2-bromo-1,3,5-trimethyl,2,4,6-trimethybromombenzene,mesitylene, 2-bromo,2,4,6-trimethylphenyl bromide,1-bromo-2,4,6-trimethylbenzene,2-bromo-1,3,5-trimethyl-benzene
IUPAC Name	2-bromo-1,3,5-trimethylbenzene
InChI Key	RRTLQRYOJOSPEA-UHFFFAOYSA-N
Molecular Formula	C9H11Br

5,910

4-Bromo-2-nitrophenylacetic Acid 97.0+%, TCI America™

CAS: 6127-11-3 Molecular Formula: C8H5BrNO4 Molecular Weight (g/mol): 259.04 MDL Number: MFCD05663950 InChI Key: LBZPHZBNFDOCCR-UHFFFAOYSA-M PubChem CID: 271551 SMILES: C1=CC(=C(C=C1Br)[N+](=O)[O-])CC(=O)O

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Specifications

PubChem CID	271551
CAS	6127-11-3
Molecular Weight (g/mol)	259.04
MDL Number	MFCD05663950
SMILES	C1=CC(=C(C=C1Br)[N+](=O)[O-])CC(=O)O
InChI Key	LBZPHZBNFDOCCR-UHFFFAOYSA-M
Molecular Formula	C8H5BrNO4

Benzene and substituted derivatives

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