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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2,956 – 2,970 of 57,266 results

2,956

4-(2-Thienyl)benzoic acid, 96%

CAS: 29886-62-2 Molecular Formula: C11H8O2S Molecular Weight (g/mol): 204.243 MDL Number: MFCD00690742 InChI Key: CVDUBQJEQNRCIZ-UHFFFAOYSA-N Synonym: 4-thiophen-2-yl benzoic acid,4-2-thienyl benzoic acid,4-thiophen-2-yl-benzoic acid,benzoic acid,4-2-thienyl,benzoic acid, 4-2-thienyl,pubchem12353,acmc-1cb4z,4-2-thienyl benzoicacid,4-thien-2-ylbenzoic acid,amtda058 PubChem CID: 736498 IUPAC Name: 4-thiophen-2-ylbenzoic acid SMILES: C1=CSC(=C1)C2=CC=C(C=C2)C(=O)O

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Specifications

PubChem CID	736498
CAS	29886-62-2
Molecular Weight (g/mol)	204.243
MDL Number	MFCD00690742
SMILES	C1=CSC(=C1)C2=CC=C(C=C2)C(=O)O
Synonym	4-thiophen-2-yl benzoic acid,4-2-thienyl benzoic acid,4-thiophen-2-yl-benzoic acid,benzoic acid,4-2-thienyl,benzoic acid, 4-2-thienyl,pubchem12353,acmc-1cb4z,4-2-thienyl benzoicacid,4-thien-2-ylbenzoic acid,amtda058
IUPAC Name	4-thiophen-2-ylbenzoic acid
InChI Key	CVDUBQJEQNRCIZ-UHFFFAOYSA-N
Molecular Formula	C11H8O2S

2,957

3-Bromo-4-methoxyphenylacetonitrile, 99%

CAS: 772-59-8 Molecular Formula: C9H8BrNO Molecular Weight (g/mol): 226.07 MDL Number: MFCD00016391 InChI Key: OBJKHHRZMIIEOK-UHFFFAOYSA-N PubChem CID: 522655 IUPAC Name: 2-(3-bromo-4-methoxyphenyl)acetonitrile SMILES: COC1=C(Br)C=C(CC#N)C=C1

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Specifications

PubChem CID	522655
CAS	772-59-8
Molecular Weight (g/mol)	226.07
MDL Number	MFCD00016391
SMILES	COC1=C(Br)C=C(CC#N)C=C1
IUPAC Name	2-(3-bromo-4-methoxyphenyl)acetonitrile
InChI Key	OBJKHHRZMIIEOK-UHFFFAOYSA-N
Molecular Formula	C9H8BrNO

2,958

(R)-3-Bromo-alpha-methylbenzyl alcohol, 95%, 98% ee

CAS: 134615-24-0 Molecular Formula: C₈H₉BrO Molecular Weight (g/mol): 201.06 MDL Number: MFCD06658929 InChI Key: ULMJQMDYAOJNCC-ZCFIWIBFSA-N Synonym: r-1-3-bromophenyl ethanol,1r-1-3-bromophenyl ethanol,1r-1-3-bromophenyl ethan-1-ol,pubchem15565,r-1-m-bromophenyl ethanol,r-1-3-bromo-phenyl-ethanol,r-3-bromo-alpha-methylbenzyl alcohol,benzenemethanol, 3-bromo-a-methyl-, ar PubChem CID: 2734889 IUPAC Name: (1R)-1-(3-bromophenyl)ethanol SMILES: CC(C1=CC(=CC=C1)Br)O

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Specifications

PubChem CID	2734889
CAS	134615-24-0
Molecular Weight (g/mol)	201.06
MDL Number	MFCD06658929
SMILES	CC(C1=CC(=CC=C1)Br)O
Synonym	r-1-3-bromophenyl ethanol,1r-1-3-bromophenyl ethanol,1r-1-3-bromophenyl ethan-1-ol,pubchem15565,r-1-m-bromophenyl ethanol,r-1-3-bromo-phenyl-ethanol,r-3-bromo-alpha-methylbenzyl alcohol,benzenemethanol, 3-bromo-a-methyl-, ar
IUPAC Name	(1R)-1-(3-bromophenyl)ethanol
InChI Key	ULMJQMDYAOJNCC-ZCFIWIBFSA-N
Molecular Formula	C₈H₉BrO

2,959

1-Bromo-3-fluorobenzene, 99%

CAS: 1073-06-9 Molecular Formula: C6H4BrF MDL Number: MFCD00000326 InChI Key: QDFKKJYEIFBEFC-UHFFFAOYSA-N Synonym: 3-bromofluorobenzene,m-bromofluorobenzene,m-fluorobromobenzene,benzene, 1-bromo-3-fluoro,3-bromfluorbenzen,3-fluorobromobenzene,m-fluorophenyl bromide,1-fluoro-3-bromobenzene,3-fluoro bromobenzene,benzene, 1-fluoro-3-bromo PubChem CID: 14082 IUPAC Name: 1-bromo-3-fluorobenzene

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Specifications

PubChem CID	14082
CAS	1073-06-9
MDL Number	MFCD00000326
Synonym	3-bromofluorobenzene,m-bromofluorobenzene,m-fluorobromobenzene,benzene, 1-bromo-3-fluoro,3-bromfluorbenzen,3-fluorobromobenzene,m-fluorophenyl bromide,1-fluoro-3-bromobenzene,3-fluoro bromobenzene,benzene, 1-fluoro-3-bromo
IUPAC Name	1-bromo-3-fluorobenzene
InChI Key	QDFKKJYEIFBEFC-UHFFFAOYSA-N
Molecular Formula	C6H4BrF

2,960

Sodium Salicylate, Crystal, USP, 98-102%, Spectrum™ Chemical

CAS: 54-21-7 Molecular Formula: C7H5NaO3 Molecular Weight (g/mol): 160.10 InChI Key: ABBQHOQBGMUPJH-UHFFFAOYSA-M IUPAC Name: sodium 2-hydroxybenzoate SMILES: [Na+].OC1=CC=CC=C1C([O-])=O

Pricing & Availability
Specifications

CAS	54-21-7
Molecular Weight (g/mol)	160.10
SMILES	[Na+].OC1=CC=CC=C1C([O-])=O
IUPAC Name	sodium 2-hydroxybenzoate
InChI Key	ABBQHOQBGMUPJH-UHFFFAOYSA-M
Molecular Formula	C7H5NaO3

2,961

Methyl 2-nitrobenzoate, 98+%

CAS: 606-27-9 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00007136 InChI Key: AOXPHVNMBPFOFS-UHFFFAOYSA-N Synonym: methyl o-nitrobenzoate,benzoic acid, 2-nitro-, methyl ester,2-nitro-benzoic acid methyl ester,benzoic acid, o-nitro-, methyl ester,2-nitrobenzoic acid methyl ester,methyl-2-nitrobenzoate,methyl o-nitro benzoate,methyl ortho-nitrobenzoate,acmc-209ml4,nitrobenzoic acid methyl ester PubChem CID: 69072 IUPAC Name: methyl 2-nitrobenzoate SMILES: COC(=O)C1=CC=CC=C1[N+](=O)[O-]

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Specifications

PubChem CID	69072
CAS	606-27-9
Molecular Weight (g/mol)	181.147
MDL Number	MFCD00007136
SMILES	COC(=O)C1=CC=CC=C1[N+](=O)[O-]
Synonym	methyl o-nitrobenzoate,benzoic acid, 2-nitro-, methyl ester,2-nitro-benzoic acid methyl ester,benzoic acid, o-nitro-, methyl ester,2-nitrobenzoic acid methyl ester,methyl-2-nitrobenzoate,methyl o-nitro benzoate,methyl ortho-nitrobenzoate,acmc-209ml4,nitrobenzoic acid methyl ester
IUPAC Name	methyl 2-nitrobenzoate
InChI Key	AOXPHVNMBPFOFS-UHFFFAOYSA-N
Molecular Formula	C8H7NO4

2,962

2-Chloro-5-nitrobenzotrifluoride, 98%

CAS: 777-37-7 Molecular Formula: C7H3ClF3NO2 Molecular Weight (g/mol): 225.55 MDL Number: MFCD00007296 InChI Key: HQROXDLWVGFPDE-UHFFFAOYSA-N Synonym: 2-chloro-5-nitrobenzotrifluoride,1-chloro-4-nitro-2-trifluoromethyl benzene,4-chloro-3-trifluoromethyl nitrobenzene,benzene, 1-chloro-4-nitro-2-trifluoromethyl,3-trifluoromethyl-4-chloronitrobenzene,2-trifluoromethyl-4-nitrochlorobenzene,2-chloro-5-nitro-a,a,a-trifluorotoluene,4-nitro-2-trifluoromethyl chlorobenzene,1-chloro-2-trifluoromethyl-4-nitrobenzene,5-nitro-2-chlorobenzotrifluoride PubChem CID: 61213 IUPAC Name: 1-chloro-4-nitro-2-(trifluoromethyl)benzene SMILES: [O-][N+](=O)C1=CC=C(Cl)C(=C1)C(F)(F)F

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Specifications

PubChem CID	61213
CAS	777-37-7
Molecular Weight (g/mol)	225.55
MDL Number	MFCD00007296
SMILES	[O-][N+](=O)C1=CC=C(Cl)C(=C1)C(F)(F)F
Synonym	2-chloro-5-nitrobenzotrifluoride,1-chloro-4-nitro-2-trifluoromethyl benzene,4-chloro-3-trifluoromethyl nitrobenzene,benzene, 1-chloro-4-nitro-2-trifluoromethyl,3-trifluoromethyl-4-chloronitrobenzene,2-trifluoromethyl-4-nitrochlorobenzene,2-chloro-5-nitro-a,a,a-trifluorotoluene,4-nitro-2-trifluoromethyl chlorobenzene,1-chloro-2-trifluoromethyl-4-nitrobenzene,5-nitro-2-chlorobenzotrifluoride
IUPAC Name	1-chloro-4-nitro-2-(trifluoromethyl)benzene
InChI Key	HQROXDLWVGFPDE-UHFFFAOYSA-N
Molecular Formula	C7H3ClF3NO2

2,963

4-Nitrophthalic acid, 99%

CAS: 610-27-5 Molecular Formula: C₈H₅NO₆ Molecular Weight (g/mol): 211.13 InChI Key: SLBQXWXKPNIVSQ-UHFFFAOYSA-N Synonym: 4-nitrophthalic acid,5-nitrophthalic acid,4-nitrobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylic acid, 4-nitro,phthalic acid, 4-nitro,4-nitrophthalicacid,p-nitrophthalic acid,4-nitro-phthalic acid,acmc-209mo8 PubChem CID: 69121 SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)C(=O)O

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Specifications

PubChem CID	69121
CAS	610-27-5
Molecular Weight (g/mol)	211.13
SMILES	C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)C(=O)O
Synonym	4-nitrophthalic acid,5-nitrophthalic acid,4-nitrobenzene-1,2-dicarboxylic acid,1,2-benzenedicarboxylic acid, 4-nitro,phthalic acid, 4-nitro,4-nitrophthalicacid,p-nitrophthalic acid,4-nitro-phthalic acid,acmc-209mo8
InChI Key	SLBQXWXKPNIVSQ-UHFFFAOYSA-N
Molecular Formula	C₈H₅NO₆

2,964

2-(Bromomethyl)benzeneboronic acid, 97%

CAS: 91983-14-1 Molecular Formula: C7H8BBrO2 Molecular Weight (g/mol): 214.85 MDL Number: MFCD01318941 InChI Key: MYVJCOQGXCONPE-UHFFFAOYSA-N Synonym: 2-bromomethylphenylboronic acid,2-bromomethyl benzeneboronic acid,2-bromomethyl phenylboronic acid,2-bromomethyl phenyl boronic acid,2-bromomethylphenylboronicacid,2-boronobenzyl bromide,o-boronobenzyl bromide,2-bromomethylphenyl boronic acid,pubchem7781 PubChem CID: 2773278 IUPAC Name: [2-(bromomethyl)phenyl]boronic acid SMILES: OB(O)C1=CC=CC=C1CBr

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Specifications

PubChem CID	2773278
CAS	91983-14-1
Molecular Weight (g/mol)	214.85
MDL Number	MFCD01318941
SMILES	OB(O)C1=CC=CC=C1CBr
Synonym	2-bromomethylphenylboronic acid,2-bromomethyl benzeneboronic acid,2-bromomethyl phenylboronic acid,2-bromomethyl phenyl boronic acid,2-bromomethylphenylboronicacid,2-boronobenzyl bromide,o-boronobenzyl bromide,2-bromomethylphenyl boronic acid,pubchem7781
IUPAC Name	[2-(bromomethyl)phenyl]boronic acid
InChI Key	MYVJCOQGXCONPE-UHFFFAOYSA-N
Molecular Formula	C7H8BBrO2

2,965

(R)-2,2'-Bis[bis(3,5-trifluoromethylphenyl)phosphino]-4,4',6,6'-tetramethoxybiphenyl, 97+%, Thermo Scientific Chemicals

CAS: 1365531-84-5 Molecular Formula: C48H28F24O4P2 Molecular Weight (g/mol): 1186.66 MDL Number: MFCD19443625 InChI Key: JDKXXRZDVSJSNQ-UHFFFAOYSA-N Synonym: r-2,2'-bis bis 3,5-trifluoromethylphenyl phosphino-4,4',6,6'-tetramethoxybiphenyl,s-2,2'-bis bis 3,5-trifluoromethylphenyl phosphino-4,4',6,6'-tetramethoxybiphenyl,ar-2,2',4,4'-tetramethoxy-6,6'-bis bis 3,5-bis trifluoromethyl phenyl phosphino biphenyl,r-4,4',6,6'-tetramethoxybiphenyl-2,2'-diyl bis bis 3,5-bis trifluoromethyl phenyl phosphine,r-2,2'-bis bis 3,5-trifluoromethylphenyl phosphino-4,4',6,6'-tetramethoxy-1,1'-biphenyl,s-4,4',6,6'-tetramethoxybiphenyl-2,2'-diyl bis bis 3,5-bis trifluoromethyl phenyl phosphine,s-2,2'-bis bis 3,5-trifluoromethylphenyl phosphino-4,4',6,6'-tetramethoxy-1,1'-biphenyl,bis 3,5-bis trifluoromethyl phenyl 2'-bis 3,5-bis trifluoromethyl phenyl phosphanyl-4,4',6,6'-tetramethoxy-1,1'-biphenyl-2-yl phosphane PubChem CID: 87111592 IUPAC Name: [2-[2-bis[3,5-bis(trifluoromethyl)phenyl]phosphanyl-4,6-dimethoxyphenyl]-3,5-dimethoxyphenyl]-bis[3,5-bis(trifluoromethyl)phenyl]phosphane SMILES: COC1=CC(OC)=C(C(=C1)P(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C1=C(OC)C=C(OC)C=C1P(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

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Specifications

PubChem CID	87111592
CAS	1365531-84-5
Molecular Weight (g/mol)	1186.66
MDL Number	MFCD19443625
SMILES	COC1=CC(OC)=C(C(=C1)P(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C1=C(OC)C=C(OC)C=C1P(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F
Synonym	r-2,2'-bis bis 3,5-trifluoromethylphenyl phosphino-4,4',6,6'-tetramethoxybiphenyl,s-2,2'-bis bis 3,5-trifluoromethylphenyl phosphino-4,4',6,6'-tetramethoxybiphenyl,ar-2,2',4,4'-tetramethoxy-6,6'-bis bis 3,5-bis trifluoromethyl phenyl phosphino biphenyl,r-4,4',6,6'-tetramethoxybiphenyl-2,2'-diyl bis bis 3,5-bis trifluoromethyl phenyl phosphine,r-2,2'-bis bis 3,5-trifluoromethylphenyl phosphino-4,4',6,6'-tetramethoxy-1,1'-biphenyl,s-4,4',6,6'-tetramethoxybiphenyl-2,2'-diyl bis bis 3,5-bis trifluoromethyl phenyl phosphine,s-2,2'-bis bis 3,5-trifluoromethylphenyl phosphino-4,4',6,6'-tetramethoxy-1,1'-biphenyl,bis 3,5-bis trifluoromethyl phenyl 2'-bis 3,5-bis trifluoromethyl phenyl phosphanyl-4,4',6,6'-tetramethoxy-1,1'-biphenyl-2-yl phosphane
IUPAC Name	[2-[2-bis[3,5-bis(trifluoromethyl)phenyl]phosphanyl-4,6-dimethoxyphenyl]-3,5-dimethoxyphenyl]-bis[3,5-bis(trifluoromethyl)phenyl]phosphane
InChI Key	JDKXXRZDVSJSNQ-UHFFFAOYSA-N
Molecular Formula	C48H28F24O4P2

2,966

3-Bromo-2,6-difluorobenzaldehyde, 98%

CAS: 398456-82-1 Molecular Formula: C7H3BrF2O Molecular Weight (g/mol): 221.001 MDL Number: MFCD08282773 InChI Key: OXBHKEYDKAWFLS-UHFFFAOYSA-N PubChem CID: 22139701 IUPAC Name: 3-bromo-2,6-difluorobenzaldehyde SMILES: C1=CC(=C(C(=C1F)C=O)F)Br

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Specifications

PubChem CID	22139701
CAS	398456-82-1
Molecular Weight (g/mol)	221.001
MDL Number	MFCD08282773
SMILES	C1=CC(=C(C(=C1F)C=O)F)Br
IUPAC Name	3-bromo-2,6-difluorobenzaldehyde
InChI Key	OXBHKEYDKAWFLS-UHFFFAOYSA-N
Molecular Formula	C7H3BrF2O

2,967

4-(Trifluoromethylsulfonyl)phenylacetic acid, 98%

CAS: 1099597-82-6 Molecular Formula: C9H7F3O4S Molecular Weight (g/mol): 268.206 MDL Number: MFCD04973012 InChI Key: FIEUCHICQSJBAU-UHFFFAOYSA-N Synonym: 4-trifluoromethylsulfony phenylacetic acid,2-4-trifluoromethyl sulfonyl phenyl acetic acid,4-trifluoromethanesulfonylphenyl acetic acid,4-trifluoromethylsulfonyl phenylacetic acid,4-trifluoromethanesulfonyl phenyl acetic acid PubChem CID: 40427164 IUPAC Name: 2-[4-(trifluoromethylsulfonyl)phenyl]acetic acid SMILES: C1=CC(=CC=C1CC(=O)O)S(=O)(=O)C(F)(F)F

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Specifications

PubChem CID	40427164
CAS	1099597-82-6
Molecular Weight (g/mol)	268.206
MDL Number	MFCD04973012
SMILES	C1=CC(=CC=C1CC(=O)O)S(=O)(=O)C(F)(F)F
Synonym	4-trifluoromethylsulfony phenylacetic acid,2-4-trifluoromethyl sulfonyl phenyl acetic acid,4-trifluoromethanesulfonylphenyl acetic acid,4-trifluoromethylsulfonyl phenylacetic acid,4-trifluoromethanesulfonyl phenyl acetic acid
IUPAC Name	2-[4-(trifluoromethylsulfonyl)phenyl]acetic acid
InChI Key	FIEUCHICQSJBAU-UHFFFAOYSA-N
Molecular Formula	C9H7F3O4S

2,968

5-(2-Bromophenyl)-3-methyl-1,2,4-oxadiazole 97+%, Thermo Scientific™

CAS: 375857-64-0 Molecular Formula: C9H7BrN2O Molecular Weight (g/mol): 239.072 InChI Key: NYAFKUCVAVUCHW-UHFFFAOYSA-N PubChem CID: 18001310 IUPAC Name: 5-(2-bromophenyl)-3-methyl-1,2,4-oxadiazole SMILES: CC1=NOC(=N1)C2=CC=CC=C2Br

Pricing & Availability
Specifications

PubChem CID	18001310
CAS	375857-64-0
Molecular Weight (g/mol)	239.072
SMILES	CC1=NOC(=N1)C2=CC=CC=C2Br
IUPAC Name	5-(2-bromophenyl)-3-methyl-1,2,4-oxadiazole
InChI Key	NYAFKUCVAVUCHW-UHFFFAOYSA-N
Molecular Formula	C9H7BrN2O

2,969

N-[4-(2-Furyl)benzyl]-N-methylamine, ≥95%, Thermo Scientific™

CAS: 859850-67-2 Molecular Formula: C12H13NO Molecular Weight (g/mol): 187.24 MDL Number: MFCD08060507 InChI Key: QJHXIMBULPYCDO-UHFFFAOYSA-N Synonym: n-4-2-furyl benzyl-n-methylamine,4-furan-2-yl phenyl methyl methyl amine,benzenemethanamine,4-2-furanyl-n-methyl,1-4-furan-2-yl phenyl-n-methylmethanamine,4-2-furyl phenyl methyl methylamine PubChem CID: 7537512 IUPAC Name: {[4-(furan-2-yl)phenyl]methyl}(methyl)amine SMILES: CNCC1=CC=C(C=C1)C1=CC=CO1

Pricing & Availability
Specifications

PubChem CID	7537512
CAS	859850-67-2
Molecular Weight (g/mol)	187.24
MDL Number	MFCD08060507
SMILES	CNCC1=CC=C(C=C1)C1=CC=CO1
Synonym	n-4-2-furyl benzyl-n-methylamine,4-furan-2-yl phenyl methyl methyl amine,benzenemethanamine,4-2-furanyl-n-methyl,1-4-furan-2-yl phenyl-n-methylmethanamine,4-2-furyl phenyl methyl methylamine
IUPAC Name	{[4-(furan-2-yl)phenyl]methyl}(methyl)amine
InChI Key	QJHXIMBULPYCDO-UHFFFAOYSA-N
Molecular Formula	C12H13NO

2,970

4-Isopropylphenol, 98%

CAS: 99-89-8 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00002372 InChI Key: YQUQWHNMBPIWGK-UHFFFAOYSA-N Synonym: 4-isopropylphenol,p-isopropylphenol,p-cumenol,australol,phenol, 4-1-methylethyl,4-1-methylethyl phenol,1-hydroxy-4-isopropylbenzene,4-propan-2-yl phenol,phenol, p-isopropyl,para-isopropylphenol PubChem CID: 7465 IUPAC Name: 4-propan-2-ylphenol SMILES: CC(C)C1=CC=C(C=C1)O

Pricing & Availability
Specifications

PubChem CID	7465
CAS	99-89-8
Molecular Weight (g/mol)	136.194
MDL Number	MFCD00002372
SMILES	CC(C)C1=CC=C(C=C1)O
Synonym	4-isopropylphenol,p-isopropylphenol,p-cumenol,australol,phenol, 4-1-methylethyl,4-1-methylethyl phenol,1-hydroxy-4-isopropylbenzene,4-propan-2-yl phenol,phenol, p-isopropyl,para-isopropylphenol
IUPAC Name	4-propan-2-ylphenol
InChI Key	YQUQWHNMBPIWGK-UHFFFAOYSA-N
Molecular Formula	C9H12O

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Benzene and substituted derivatives

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Sodium Salicylate, Crystal, USP, 98-102%, Spectrum™ Chemical Small and Specialty Supplier PartnerSmall and/or specialty supplier based on Federal laws and SBA requirements.Learn More

Sodium Salicylate, Crystal, USP, 98-102%, Spectrum™ Chemical