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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6,991 – 7,005 of 57,364 results

6,991

4-(Trifluoromethylthio)benzoyl Chloride 98.0+%, TCI America™

CAS: 330-14-3 Molecular Formula: C8H4ClF3OS Molecular Weight (g/mol): 240.624 MDL Number: MFCD01631632 InChI Key: BCMFTOCCLOAGBP-UHFFFAOYSA-N Synonym: 4-trifluoromethylthio benzoyl chloride,4-trifluoromethyl thio benzoyl chloride,4-trifluoromethylsulfanyl benzoyl chloride,4-trifluoromethyl sulfanyl benzoyl chloride,4-trifluomethylthio benzoyl chloride,benzoyl chloride, 4-trifluoromethyl thio,4-trifluoromethyl sulphanyl benzoyl chloride,4-trifluoromethylsulfanyl-benzoyl chloride,acmc-209hxt,4-trifluoromethylthiobenzoylchloride PubChem CID: 2777865 IUPAC Name: 4-(trifluoromethylsulfanyl)benzoyl chloride SMILES: C1=CC(=CC=C1C(=O)Cl)SC(F)(F)F

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Specifications

PubChem CID	2777865
CAS	330-14-3
Molecular Weight (g/mol)	240.624
MDL Number	MFCD01631632
SMILES	C1=CC(=CC=C1C(=O)Cl)SC(F)(F)F
Synonym	4-trifluoromethylthio benzoyl chloride,4-trifluoromethyl thio benzoyl chloride,4-trifluoromethylsulfanyl benzoyl chloride,4-trifluoromethyl sulfanyl benzoyl chloride,4-trifluomethylthio benzoyl chloride,benzoyl chloride, 4-trifluoromethyl thio,4-trifluoromethyl sulphanyl benzoyl chloride,4-trifluoromethylsulfanyl-benzoyl chloride,acmc-209hxt,4-trifluoromethylthiobenzoylchloride
IUPAC Name	4-(trifluoromethylsulfanyl)benzoyl chloride
InChI Key	BCMFTOCCLOAGBP-UHFFFAOYSA-N
Molecular Formula	C8H4ClF3OS

6,992

2-Bromobenzotrifluoride 98.0+%, TCI America™

CAS: 392-83-6 Molecular Formula: C7H4BrF3 Molecular Weight (g/mol): 225.008 MDL Number: MFCD00000373 InChI Key: RWXUNIMBRXGNEP-UHFFFAOYSA-N Synonym: 2-bromobenzotrifluoride,1-bromo-2-trifluoromethyl benzene,o-bromobenzotrifluoride,benzene, 1-bromo-2-trifluoromethyl,2-bromo-alpha,alpha,alpha-trifluorotoluene,2-brombenzotrifluorid,o-bromobenzyltrifluoride,o-trifluoromethyl bromobenzene,2-bromotrifluorotoluene,2-brombenzotrifluorid czech PubChem CID: 9806 IUPAC Name: 1-bromo-2-(trifluoromethyl)benzene SMILES: C1=CC=C(C(=C1)C(F)(F)F)Br

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Specifications

PubChem CID	9806
CAS	392-83-6
Molecular Weight (g/mol)	225.008
MDL Number	MFCD00000373
SMILES	C1=CC=C(C(=C1)C(F)(F)F)Br
Synonym	2-bromobenzotrifluoride,1-bromo-2-trifluoromethyl benzene,o-bromobenzotrifluoride,benzene, 1-bromo-2-trifluoromethyl,2-bromo-alpha,alpha,alpha-trifluorotoluene,2-brombenzotrifluorid,o-bromobenzyltrifluoride,o-trifluoromethyl bromobenzene,2-bromotrifluorotoluene,2-brombenzotrifluorid czech
IUPAC Name	1-bromo-2-(trifluoromethyl)benzene
InChI Key	RWXUNIMBRXGNEP-UHFFFAOYSA-N
Molecular Formula	C7H4BrF3

6,993

2-(3-Fluorophenyl)ethyl Bromide 97.0+%, TCI America™

CAS: 25017-13-4 Molecular Formula: C8H8BrF Molecular Weight (g/mol): 203.054 MDL Number: MFCD03095397 InChI Key: GLVSPVSJMYQIPJ-UHFFFAOYSA-N Synonym: 1-(2-Bromoethyl)-3-fluorobenzene, 3-Fluorophenethyl Bromide PubChem CID: 573129 IUPAC Name: 1-(2-bromoethyl)-3-fluorobenzene SMILES: C1=CC(=CC(=C1)F)CCBr

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Specifications

PubChem CID	573129
CAS	25017-13-4
Molecular Weight (g/mol)	203.054
MDL Number	MFCD03095397
SMILES	C1=CC(=CC(=C1)F)CCBr
Synonym	1-(2-Bromoethyl)-3-fluorobenzene, 3-Fluorophenethyl Bromide
IUPAC Name	1-(2-bromoethyl)-3-fluorobenzene
InChI Key	GLVSPVSJMYQIPJ-UHFFFAOYSA-N
Molecular Formula	C8H8BrF

6,994

alpha,alpha'-Bis(4-hydroxyphenyl)-1,4-diisopropylbenzene 98.0+%, TCI America™

CAS: 2167-51-3 Molecular Formula: C24H26O2 Molecular Weight (g/mol): 346.47 MDL Number: MFCD00191315 InChI Key: GIXXQTYGFOHYPT-UHFFFAOYSA-N PubChem CID: 630355 IUPAC Name: 4-[2-[4-[2-(4-hydroxyphenyl)propan-2-yl]phenyl]propan-2-yl]phenol SMILES: CC(C)(C1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)O)C3=CC=C(C=C3)O

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Specifications

PubChem CID	630355
CAS	2167-51-3
Molecular Weight (g/mol)	346.47
MDL Number	MFCD00191315
SMILES	CC(C)(C1=CC=C(C=C1)C(C)(C)C2=CC=C(C=C2)O)C3=CC=C(C=C3)O
IUPAC Name	4-[2-[4-[2-(4-hydroxyphenyl)propan-2-yl]phenyl]propan-2-yl]phenol
InChI Key	GIXXQTYGFOHYPT-UHFFFAOYSA-N
Molecular Formula	C24H26O2

6,995

2-Chloro-5-(trifluoromethyl)phenyl Isocyanate 98.0+%, TCI America™

CAS: 50528-86-4 Molecular Formula: C8H3ClF3NO Molecular Weight (g/mol): 221.563 MDL Number: MFCD00037029 InChI Key: WEPYOPYMWSHRIW-UHFFFAOYSA-N Synonym: 2-chloro-5-trifluoromethyl phenyl isocyanate,1-chloro-2-isocyanato-4-trifluoromethyl benzene,isocyanic acid 2-chloro-5-trifluoromethyl phenyl ester,2-chloro-5-trifluoromethylphenyl isocyanate,2-chloro-5-trifluoromethyl phenylisocyanate,2-chloro-5-trifluoromethyl benzenisocyanate,pubchem5026,acmc-1aq1j,timtec-bb sbb006656,1-mercapto-2-methyl-propan-2-ol PubChem CID: 2733263 IUPAC Name: 1-chloro-2-isocyanato-4-(trifluoromethyl)benzene SMILES: C1=CC(=C(C=C1C(F)(F)F)N=C=O)Cl

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Specifications

PubChem CID	2733263
CAS	50528-86-4
Molecular Weight (g/mol)	221.563
MDL Number	MFCD00037029
SMILES	C1=CC(=C(C=C1C(F)(F)F)N=C=O)Cl
Synonym	2-chloro-5-trifluoromethyl phenyl isocyanate,1-chloro-2-isocyanato-4-trifluoromethyl benzene,isocyanic acid 2-chloro-5-trifluoromethyl phenyl ester,2-chloro-5-trifluoromethylphenyl isocyanate,2-chloro-5-trifluoromethyl phenylisocyanate,2-chloro-5-trifluoromethyl benzenisocyanate,pubchem5026,acmc-1aq1j,timtec-bb sbb006656,1-mercapto-2-methyl-propan-2-ol
IUPAC Name	1-chloro-2-isocyanato-4-(trifluoromethyl)benzene
InChI Key	WEPYOPYMWSHRIW-UHFFFAOYSA-N
Molecular Formula	C8H3ClF3NO

6,996

4-Fluorodiphenylamine 98.0+%, TCI America™

CAS: 330-83-6 Molecular Formula: C12H10FN Molecular Weight (g/mol): 187.217 MDL Number: MFCD01318538 InChI Key: RBWCFTJQRDTIBX-UHFFFAOYSA-N Synonym: N-(4-Fluorophenyl)aniline PubChem CID: 2774468 IUPAC Name: 4-fluoro-N-phenylaniline SMILES: C1=CC=C(C=C1)NC2=CC=C(C=C2)F

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Specifications

PubChem CID	2774468
CAS	330-83-6
Molecular Weight (g/mol)	187.217
MDL Number	MFCD01318538
SMILES	C1=CC=C(C=C1)NC2=CC=C(C=C2)F
Synonym	N-(4-Fluorophenyl)aniline
IUPAC Name	4-fluoro-N-phenylaniline
InChI Key	RBWCFTJQRDTIBX-UHFFFAOYSA-N
Molecular Formula	C12H10FN

6,997

2-(4-Fluorophenyl)ethanol 97.0+%, TCI America™

CAS: 7589-27-7 Molecular Formula: C8H9FO Molecular Weight (g/mol): 140.16 MDL Number: MFCD00002898 InChI Key: MWUVGXCUHWKQJE-UHFFFAOYSA-N Synonym: 2-4-fluorophenyl ethanol,4-fluorophenethyl alcohol,4-fluorophenylethanol,benzeneethanol, 4-fluoro,2-4-fluorophenyl ethan-1-ol,4-fluorophenethylic alcohol,phenethyl alcohol, p-fluoro,4-fluorobenzeneethanol,4fa PubChem CID: 82068 IUPAC Name: 2-(4-fluorophenyl)ethan-1-ol SMILES: OCCC1=CC=C(F)C=C1

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Specifications

PubChem CID	82068
CAS	7589-27-7
Molecular Weight (g/mol)	140.16
MDL Number	MFCD00002898
SMILES	OCCC1=CC=C(F)C=C1
Synonym	2-4-fluorophenyl ethanol,4-fluorophenethyl alcohol,4-fluorophenylethanol,benzeneethanol, 4-fluoro,2-4-fluorophenyl ethan-1-ol,4-fluorophenethylic alcohol,phenethyl alcohol, p-fluoro,4-fluorobenzeneethanol,4fa
IUPAC Name	2-(4-fluorophenyl)ethan-1-ol
InChI Key	MWUVGXCUHWKQJE-UHFFFAOYSA-N
Molecular Formula	C8H9FO

6,998

4-(Chloromethyl)benzoyl Chloride 98.0+%, TCI America™

CAS: 876-08-4 Molecular Formula: C8H6Cl2O Molecular Weight (g/mol): 189.035 MDL Number: MFCD00053224 InChI Key: RCOVTJVRTZGSBP-UHFFFAOYSA-N Synonym: 4-chloromethyl benzoyl chloride,benzoyl chloride, 4-chloromethyl,4-chloromethyl benzoylchloride,4-chloromethyl-benzoyl chloride,acmc-209qop,4-chlormethylbenzoylchloride,4-chloromethylbenzoylchloride,4-chlormethyl benzoylchlorid,p-chloromethylbenzoyl chloride PubChem CID: 70136 IUPAC Name: 4-(chloromethyl)benzoyl chloride SMILES: C1=CC(=CC=C1CCl)C(=O)Cl

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Specifications

PubChem CID	70136
CAS	876-08-4
Molecular Weight (g/mol)	189.035
MDL Number	MFCD00053224
SMILES	C1=CC(=CC=C1CCl)C(=O)Cl
Synonym	4-chloromethyl benzoyl chloride,benzoyl chloride, 4-chloromethyl,4-chloromethyl benzoylchloride,4-chloromethyl-benzoyl chloride,acmc-209qop,4-chlormethylbenzoylchloride,4-chloromethylbenzoylchloride,4-chlormethyl benzoylchlorid,p-chloromethylbenzoyl chloride
IUPAC Name	4-(chloromethyl)benzoyl chloride
InChI Key	RCOVTJVRTZGSBP-UHFFFAOYSA-N
Molecular Formula	C8H6Cl2O

6,999

trans,trans-4'-Ethyl-4-(4-trifluoromethoxyphenyl)bicyclohexyl 98.0+%, TCI America™

CAS: 135734-59-7 Molecular Formula: C21H29F3O Molecular Weight (g/mol): 354.457 MDL Number: MFCD09842837 InChI Key: PBIFTROFCZATFC-UHFFFAOYSA-N PubChem CID: 604782 IUPAC Name: 1-[4-(4-ethylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene SMILES: CCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)OC(F)(F)F

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Specifications

PubChem CID	604782
CAS	135734-59-7
Molecular Weight (g/mol)	354.457
MDL Number	MFCD09842837
SMILES	CCC1CCC(CC1)C2CCC(CC2)C3=CC=C(C=C3)OC(F)(F)F
IUPAC Name	1-[4-(4-ethylcyclohexyl)cyclohexyl]-4-(trifluoromethoxy)benzene
InChI Key	PBIFTROFCZATFC-UHFFFAOYSA-N
Molecular Formula	C21H29F3O

7,000

3,5-Bis[3,5-bis(benzyloxy)benzyloxy]benzyl Bromide 97.0+%, TCI America™

CAS: 129536-41-0 Molecular Formula: C49H43BrO6 Molecular Weight (g/mol): 807.781 MDL Number: MFCD02093449 InChI Key: WEIQDYRDUFADRJ-UHFFFAOYSA-N Synonym: 3,5-Bis(3,5-dibenzyloxybenzyloxy)benzyl Bromide PubChem CID: 11967226 IUPAC Name: 1,3-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]-5-(bromomethyl)benzene SMILES: C1=CC=C(C=C1)COC2=CC(=CC(=C2)COC3=CC(=CC(=C3)CBr)OCC4=CC(=CC(=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7

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Specifications

PubChem CID	11967226
CAS	129536-41-0
Molecular Weight (g/mol)	807.781
MDL Number	MFCD02093449
SMILES	C1=CC=C(C=C1)COC2=CC(=CC(=C2)COC3=CC(=CC(=C3)CBr)OCC4=CC(=CC(=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7
Synonym	3,5-Bis(3,5-dibenzyloxybenzyloxy)benzyl Bromide
IUPAC Name	1,3-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]-5-(bromomethyl)benzene
InChI Key	WEIQDYRDUFADRJ-UHFFFAOYSA-N
Molecular Formula	C49H43BrO6

7,001

2-Chloro-4-fluorotoluene 98.0+%, TCI America™

CAS: 452-73-3 Molecular Formula: C7H6ClF Molecular Weight (g/mol): 144.573 MDL Number: MFCD00000572 InChI Key: CSARJIQZOSVYHA-UHFFFAOYSA-N Synonym: 2-chloro-4-fluorotoluene,benzene, 2-chloro-4-fluoro-1-methyl,4-fluoro-2-chlorotoluene,2-chlor-4-fluor-1-methylbenzol,pubchem1605,2-chloro-4fluorotoluene,acmc-1adyb,4-fluor-2-chlor-toluol,ksc235q0r,csarjiqzosvyha-uhfffaoysa PubChem CID: 96747 IUPAC Name: 2-chloro-4-fluoro-1-methylbenzene SMILES: CC1=C(C=C(C=C1)F)Cl

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Specifications

PubChem CID	96747
CAS	452-73-3
Molecular Weight (g/mol)	144.573
MDL Number	MFCD00000572
SMILES	CC1=C(C=C(C=C1)F)Cl
Synonym	2-chloro-4-fluorotoluene,benzene, 2-chloro-4-fluoro-1-methyl,4-fluoro-2-chlorotoluene,2-chlor-4-fluor-1-methylbenzol,pubchem1605,2-chloro-4fluorotoluene,acmc-1adyb,4-fluor-2-chlor-toluol,ksc235q0r,csarjiqzosvyha-uhfffaoysa
IUPAC Name	2-chloro-4-fluoro-1-methylbenzene
InChI Key	CSARJIQZOSVYHA-UHFFFAOYSA-N
Molecular Formula	C7H6ClF

7,002

N-Methyl-p-anisidine 96.0+%, TCI America™

CAS: 5961-59-1 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.182 MDL Number: MFCD00008399 InChI Key: JFXDIXYFXDOZIT-UHFFFAOYSA-N Synonym: n-methyl-p-anisidine,n-methyl-4-anisidine,n-methyl-4-methoxyaniline,benzenamine, 4-methoxy-n-methyl,n-methyl-p-ansidine,p-anisidine, n-methyl,4-methoxy-n-methylbenzenamine,1-methylamino-4-methoxybenzene,p-methoxy-n-methylaniline,acmc-209mes PubChem CID: 22250 IUPAC Name: 4-methoxy-N-methylaniline SMILES: CNC1=CC=C(C=C1)OC

Pricing & Availability
Specifications

PubChem CID	22250
CAS	5961-59-1
Molecular Weight (g/mol)	137.182
MDL Number	MFCD00008399
SMILES	CNC1=CC=C(C=C1)OC
Synonym	n-methyl-p-anisidine,n-methyl-4-anisidine,n-methyl-4-methoxyaniline,benzenamine, 4-methoxy-n-methyl,n-methyl-p-ansidine,p-anisidine, n-methyl,4-methoxy-n-methylbenzenamine,1-methylamino-4-methoxybenzene,p-methoxy-n-methylaniline,acmc-209mes
IUPAC Name	4-methoxy-N-methylaniline
InChI Key	JFXDIXYFXDOZIT-UHFFFAOYSA-N
Molecular Formula	C8H11NO

7,003

2-Fluoro-6-(trifluoromethyl)benzoic Acid 98.0+%, TCI America™

CAS: 32890-94-1 Molecular Formula: C8H3F4O2 Molecular Weight (g/mol): 207.10 MDL Number: MFCD00040981 InChI Key: LNARMXLVVGHCRP-UHFFFAOYSA-M Synonym: 2-fluoro-6-trifluoromethyl benzoic acid,otf-boa-6f,alpha,alpha,alpha,6-tetrafluoro-o-toluic acid,benzoic acid, 2-fluoro-6-trifluoromethyl,6-fluoro-2-trifluoromethylbenzoic acid,2-fluoro-6-trifluoromethyl-benzoic acid,6-fluoro-2-trifluoromethyl benzoic acid,pubchem4759,acmc-20a40d,rarechem al bo 0626 PubChem CID: 688123 IUPAC Name: 2-fluoro-6-(trifluoromethyl)benzoate SMILES: [O-]C(=O)C1=C(F)C=CC=C1C(F)(F)F

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Specifications

PubChem CID	688123
CAS	32890-94-1
Molecular Weight (g/mol)	207.10
MDL Number	MFCD00040981
SMILES	[O-]C(=O)C1=C(F)C=CC=C1C(F)(F)F
Synonym	2-fluoro-6-trifluoromethyl benzoic acid,otf-boa-6f,alpha,alpha,alpha,6-tetrafluoro-o-toluic acid,benzoic acid, 2-fluoro-6-trifluoromethyl,6-fluoro-2-trifluoromethylbenzoic acid,2-fluoro-6-trifluoromethyl-benzoic acid,6-fluoro-2-trifluoromethyl benzoic acid,pubchem4759,acmc-20a40d,rarechem al bo 0626
IUPAC Name	2-fluoro-6-(trifluoromethyl)benzoate
InChI Key	LNARMXLVVGHCRP-UHFFFAOYSA-M
Molecular Formula	C8H3F4O2

7,004

1-Benzyl-3-p-tolyltriazene 98.0+%, TCI America™

CAS: 17683-09-9 Molecular Formula: C14H15N3 Molecular Weight (g/mol): 225.30 MDL Number: MFCD00038226 InChI Key: IWCGEJKKDAJKJE-UHFFFAOYSA-N Synonym: 3-p-Tolyl-1-benzyltriazene PubChem CID: 87234 IUPAC Name: 1-benzyl-3-(4-methylphenyl)triaz-1-ene SMILES: CC1=CC=C(NN=NCC2=CC=CC=C2)C=C1

Pricing & Availability
Specifications

PubChem CID	87234
CAS	17683-09-9
Molecular Weight (g/mol)	225.30
MDL Number	MFCD00038226
SMILES	CC1=CC=C(NN=NCC2=CC=CC=C2)C=C1
Synonym	3-p-Tolyl-1-benzyltriazene
IUPAC Name	1-benzyl-3-(4-methylphenyl)triaz-1-ene
InChI Key	IWCGEJKKDAJKJE-UHFFFAOYSA-N
Molecular Formula	C14H15N3

7,005

4,4,5,5-Tetramethyl-2-(3,4,5-trifluorophenyl)-1,3,2-dioxaborolane 98.0+%, TCI America™

CAS: 827614-70-0 Molecular Formula: C12H14BF3O2 Molecular Weight (g/mol): 258.047 MDL Number: MFCD05663885 InChI Key: VFCTUUBAONBDJU-UHFFFAOYSA-N Synonym: 3,4,5-Trifluorophenylboronic Acid Pinacol Ester, 1,2,3-Trifluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene PubChem CID: 2760701 IUPAC Name: 4,4,5,5-tetramethyl-2-(3,4,5-trifluorophenyl)-1,3,2-dioxaborolane SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C(=C2)F)F)F

Pricing & Availability
Specifications

PubChem CID	2760701
CAS	827614-70-0
Molecular Weight (g/mol)	258.047
MDL Number	MFCD05663885
SMILES	B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C(=C2)F)F)F
Synonym	3,4,5-Trifluorophenylboronic Acid Pinacol Ester, 1,2,3-Trifluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene
IUPAC Name	4,4,5,5-tetramethyl-2-(3,4,5-trifluorophenyl)-1,3,2-dioxaborolane
InChI Key	VFCTUUBAONBDJU-UHFFFAOYSA-N
Molecular Formula	C12H14BF3O2

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