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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6,526 – 6,540 of 57,364 results

6,526

4-Nitro-2-(trifluoromethyl)benzonitrile 98.0+%, TCI America™

CAS: 320-47-8 Molecular Formula: C8H3F3N2O2 Molecular Weight (g/mol): 216.119 MDL Number: MFCD01075729 InChI Key: AGKQJEFSEQHGTA-UHFFFAOYSA-N Synonym: 4-nitro-2-trifluoromethyl benzonitrile,2-cyano-5-nitrobenzotrifluoride,2-trifluoromethyl-4-nitrobenzonitrile,benzonitrile, 4-nitro-2-trifluoromethyl,4-nitro-2-trifluoromethyl benzenecarbonitrile,pubchem4821,acmc-1ctuy,buttpark 91\04-59,4-cyano-3-trifluoromethyl nitrobenzene PubChem CID: 2775783 IUPAC Name: 4-nitro-2-(trifluoromethyl)benzonitrile SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)C#N

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Specifications

PubChem CID	2775783
CAS	320-47-8
Molecular Weight (g/mol)	216.119
MDL Number	MFCD01075729
SMILES	C1=CC(=C(C=C1[N+](=O)[O-])C(F)(F)F)C#N
Synonym	4-nitro-2-trifluoromethyl benzonitrile,2-cyano-5-nitrobenzotrifluoride,2-trifluoromethyl-4-nitrobenzonitrile,benzonitrile, 4-nitro-2-trifluoromethyl,4-nitro-2-trifluoromethyl benzenecarbonitrile,pubchem4821,acmc-1ctuy,buttpark 91\04-59,4-cyano-3-trifluoromethyl nitrobenzene
IUPAC Name	4-nitro-2-(trifluoromethyl)benzonitrile
InChI Key	AGKQJEFSEQHGTA-UHFFFAOYSA-N
Molecular Formula	C8H3F3N2O2

6,527

2,3,5,6-Tetrafluoro-4-aminobenzotrifluoride 97.0+%, TCI America™

CAS: 651-83-2 Molecular Formula: C7H2F7N Molecular Weight (g/mol): 233.089 MDL Number: MFCD00091518 InChI Key: FJOACTZFMHZHSC-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluoro-4-trifluoromethyl aniline,2,3,5,6-tetrafluoro-4-aminobenzotrifluoride,4-amino-heptafluorotoluene,4-amino-2,3,5,6-tetrafluorobenzotrifluoride,4-aminotetrafluorobenzotrifluoride,4-aminoheptafluorotoluene,2,3,5,6-tetrafluoro-4-trifluoromethyl phenylamine,benzenamine, 2,3,5,6-tetrafluoro-4-trifluoromethyl,pubchem2817,yu-wasa auxiliary PubChem CID: 616257 IUPAC Name: 2,3,5,6-tetrafluoro-4-(trifluoromethyl)aniline SMILES: C1(=C(C(=C(C(=C1F)F)N)F)F)C(F)(F)F

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Specifications

PubChem CID	616257
CAS	651-83-2
Molecular Weight (g/mol)	233.089
MDL Number	MFCD00091518
SMILES	C1(=C(C(=C(C(=C1F)F)N)F)F)C(F)(F)F
Synonym	2,3,5,6-tetrafluoro-4-trifluoromethyl aniline,2,3,5,6-tetrafluoro-4-aminobenzotrifluoride,4-amino-heptafluorotoluene,4-amino-2,3,5,6-tetrafluorobenzotrifluoride,4-aminotetrafluorobenzotrifluoride,4-aminoheptafluorotoluene,2,3,5,6-tetrafluoro-4-trifluoromethyl phenylamine,benzenamine, 2,3,5,6-tetrafluoro-4-trifluoromethyl,pubchem2817,yu-wasa auxiliary
IUPAC Name	2,3,5,6-tetrafluoro-4-(trifluoromethyl)aniline
InChI Key	FJOACTZFMHZHSC-UHFFFAOYSA-N
Molecular Formula	C7H2F7N

6,528

2-Bromo-5-fluorobenzotrifluoride 97.0+%, TCI America™

CAS: 40161-55-5 Molecular Formula: C7H3BrF4 Molecular Weight (g/mol): 243.00 MDL Number: MFCD00040937 InChI Key: AIDVAZGOACECLJ-UHFFFAOYSA-N Synonym: 2-bromo-5-fluorobenzotrifluoride,1-bromo-4-fluoro-2-trifluoromethyl benzene,1-bromo-2-trifluoromethyl-4-fluorobenzene,4-fluoro-2-trifluoromethyl bromobenzene,2-bromo-alpha,alpha,alpha,5-tetrafluorotoluene,benzene, 1-bromo-4-fluoro-2-trifluoromethyl,2-bromo-5-fluoro benzotrifluoride,pubchem1637,pubchem1643 PubChem CID: 520983 IUPAC Name: 1-bromo-4-fluoro-2-(trifluoromethyl)benzene SMILES: FC1=CC(=C(Br)C=C1)C(F)(F)F

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Specifications

PubChem CID	520983
CAS	40161-55-5
Molecular Weight (g/mol)	243.00
MDL Number	MFCD00040937
SMILES	FC1=CC(=C(Br)C=C1)C(F)(F)F
Synonym	2-bromo-5-fluorobenzotrifluoride,1-bromo-4-fluoro-2-trifluoromethyl benzene,1-bromo-2-trifluoromethyl-4-fluorobenzene,4-fluoro-2-trifluoromethyl bromobenzene,2-bromo-alpha,alpha,alpha,5-tetrafluorotoluene,benzene, 1-bromo-4-fluoro-2-trifluoromethyl,2-bromo-5-fluoro benzotrifluoride,pubchem1637,pubchem1643
IUPAC Name	1-bromo-4-fluoro-2-(trifluoromethyl)benzene
InChI Key	AIDVAZGOACECLJ-UHFFFAOYSA-N
Molecular Formula	C7H3BrF4

6,529

2,6-Dibromoanisole 98.0+%, TCI America™

CAS: 38603-09-7 Molecular Formula: C7H6Br2O Molecular Weight (g/mol): 265.93 MDL Number: MFCD00093270 InChI Key: BMZVDHQOAJUZJL-UHFFFAOYSA-N Synonym: 1,3-Dibromo-2-methoxybenzene PubChem CID: 181584 IUPAC Name: 1,3-dibromo-2-methoxybenzene SMILES: COC1=C(Br)C=CC=C1Br

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Specifications

PubChem CID	181584
CAS	38603-09-7
Molecular Weight (g/mol)	265.93
MDL Number	MFCD00093270
SMILES	COC1=C(Br)C=CC=C1Br
Synonym	1,3-Dibromo-2-methoxybenzene
IUPAC Name	1,3-dibromo-2-methoxybenzene
InChI Key	BMZVDHQOAJUZJL-UHFFFAOYSA-N
Molecular Formula	C7H6Br2O

6,530

Bis[2-(4-methoxyphenoxy)ethyl] Ether 98.0+%, TCI America™

CAS: 104104-12-3 Molecular Formula: C18H22O5 Molecular Weight (g/mol): 318.369 MDL Number: MFCD00143755 InChI Key: AJXHXSKQHBJNPB-UHFFFAOYSA-N PubChem CID: 629140 IUPAC Name: 1-methoxy-4-[2-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene SMILES: COC1=CC=C(C=C1)OCCOCCOC2=CC=C(C=C2)OC

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Specifications

PubChem CID	629140
CAS	104104-12-3
Molecular Weight (g/mol)	318.369
MDL Number	MFCD00143755
SMILES	COC1=CC=C(C=C1)OCCOCCOC2=CC=C(C=C2)OC
IUPAC Name	1-methoxy-4-[2-[2-(4-methoxyphenoxy)ethoxy]ethoxy]benzene
InChI Key	AJXHXSKQHBJNPB-UHFFFAOYSA-N
Molecular Formula	C18H22O5

6,531

2-(4-Methoxyphenyl)benzothiazole 98.0+%, TCI America™

CAS: 6265-92-5 Molecular Formula: C14H11NOS Molecular Weight (g/mol): 241.308 InChI Key: AOPZIJQISHFZBN-UHFFFAOYSA-N Synonym: 4-(2-Benzothiazolyl)anisole, 1-(2-Benzothiazolyl)-4-methoxybenzene PubChem CID: 95753 IUPAC Name: 2-(4-methoxyphenyl)-1,3-benzothiazole SMILES: COC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2

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Specifications

PubChem CID	95753
CAS	6265-92-5
Molecular Weight (g/mol)	241.308
SMILES	COC1=CC=C(C=C1)C2=NC3=CC=CC=C3S2
Synonym	4-(2-Benzothiazolyl)anisole, 1-(2-Benzothiazolyl)-4-methoxybenzene
IUPAC Name	2-(4-methoxyphenyl)-1,3-benzothiazole
InChI Key	AOPZIJQISHFZBN-UHFFFAOYSA-N
Molecular Formula	C14H11NOS

6,532

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

CAS: 104197-14-0 Molecular Formula: C7H5BrF2O Molecular Weight (g/mol): 223.02 MDL Number: MFCD01631351 InChI Key: CDOQKISJPOWBKC-UHFFFAOYSA-N Synonym: 4-bromo-2,6-difluoroanisole,5-bromo-1,3-difluoro-2-methoxy-benzene,4-bromo-2,6-difluorophenyl methyl ether,benzene, 5-bromo-1,3-difluoro-2-methoxy,pubchem8361,acmc-1bo3j,4-bromo-2,6-difluoranisole,ksc183c9b,4-bromo-2,6-difluoro-anisol,3,5-difluoro-4-methoxy-bromobenzene PubChem CID: 2773287 IUPAC Name: 5-bromo-1,3-difluoro-2-methoxybenzene SMILES: COC1=C(F)C=C(Br)C=C1F

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Specifications

PubChem CID	2773287
CAS	104197-14-0
Molecular Weight (g/mol)	223.02
MDL Number	MFCD01631351
SMILES	COC1=C(F)C=C(Br)C=C1F
Synonym	4-bromo-2,6-difluoroanisole,5-bromo-1,3-difluoro-2-methoxy-benzene,4-bromo-2,6-difluorophenyl methyl ether,benzene, 5-bromo-1,3-difluoro-2-methoxy,pubchem8361,acmc-1bo3j,4-bromo-2,6-difluoranisole,ksc183c9b,4-bromo-2,6-difluoro-anisol,3,5-difluoro-4-methoxy-bromobenzene
IUPAC Name	5-bromo-1,3-difluoro-2-methoxybenzene
InChI Key	CDOQKISJPOWBKC-UHFFFAOYSA-N
Molecular Formula	C7H5BrF2O

6,533

4-Benzyloxy-3-methoxyphenylacetic Acid 98.0+%, TCI America™

CAS: 29973-91-9 Molecular Formula: C16H16O4 Molecular Weight (g/mol): 272.3 MDL Number: MFCD00185562 InChI Key: AYCIHUSEBJLTBF-UHFFFAOYSA-N PubChem CID: 297964 IUPAC Name: 2-(3-methoxy-4-phenylmethoxyphenyl)acetic acid SMILES: COC1=C(C=CC(=C1)CC(=O)O)OCC2=CC=CC=C2

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Specifications

PubChem CID	297964
CAS	29973-91-9
Molecular Weight (g/mol)	272.3
MDL Number	MFCD00185562
SMILES	COC1=C(C=CC(=C1)CC(=O)O)OCC2=CC=CC=C2
IUPAC Name	2-(3-methoxy-4-phenylmethoxyphenyl)acetic acid
InChI Key	AYCIHUSEBJLTBF-UHFFFAOYSA-N
Molecular Formula	C16H16O4

6,534

3-Chloro-4-fluoroanisole 97.0+%, TCI America™

CAS: 202925-07-3 Molecular Formula: C7H6ClFO Molecular Weight (g/mol): 160.572 MDL Number: MFCD00070778 InChI Key: RWKKEILFRAYSDQ-UHFFFAOYSA-N Synonym: 3-chloro-4-fluoroanisole,benzene, 2-chloro-1-fluoro-4-methoxy,pubchem2660,acmc-1ckw3,2-chloro-1-fluoro-4-methoxy-benzene,benzene,2-chloro-1-fluoro-4-methoxy,2-chloranyl-1-fluoranyl-4-methoxy-benzene PubChem CID: 2773585 IUPAC Name: 2-chloro-1-fluoro-4-methoxybenzene SMILES: COC1=CC(=C(C=C1)F)Cl

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Specifications

PubChem CID	2773585
CAS	202925-07-3
Molecular Weight (g/mol)	160.572
MDL Number	MFCD00070778
SMILES	COC1=CC(=C(C=C1)F)Cl
Synonym	3-chloro-4-fluoroanisole,benzene, 2-chloro-1-fluoro-4-methoxy,pubchem2660,acmc-1ckw3,2-chloro-1-fluoro-4-methoxy-benzene,benzene,2-chloro-1-fluoro-4-methoxy,2-chloranyl-1-fluoranyl-4-methoxy-benzene
IUPAC Name	2-chloro-1-fluoro-4-methoxybenzene
InChI Key	RWKKEILFRAYSDQ-UHFFFAOYSA-N
Molecular Formula	C7H6ClFO

6,535

[(4-Methoxyphenyl)ethynyl]trimethylsilane 97.0+%, TCI America™

CAS: 3989-14-8 Molecular Formula: C12H16OSi Molecular Weight (g/mol): 204.34 MDL Number: MFCD04039887 InChI Key: GODVAYLZXZQBFP-UHFFFAOYSA-N PubChem CID: 3497861 IUPAC Name: [2-(4-methoxyphenyl)ethynyl]trimethylsilane SMILES: COC1=CC=C(C=C1)C#C[Si](C)(C)C

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Specifications

PubChem CID	3497861
CAS	3989-14-8
Molecular Weight (g/mol)	204.34
MDL Number	MFCD04039887
SMILES	COC1=CC=C(C=C1)C#C[Si](C)(C)C
IUPAC Name	[2-(4-methoxyphenyl)ethynyl]trimethylsilane
InChI Key	GODVAYLZXZQBFP-UHFFFAOYSA-N
Molecular Formula	C12H16OSi

6,536

3,4-Difluoroanisole 97.0+%, TCI America™

CAS: 115144-40-6 Molecular Formula: C7H6F2O Molecular Weight (g/mol): 144.121 MDL Number: MFCD00010730 InChI Key: DSEVNUCNUTYYHW-UHFFFAOYSA-N Synonym: 3,4-difluoroanisole,1,2-difluoro-4-methoxy-benzene,benzene, 1,2-difluoro-4-methoxy,3,4-difluoro-1-methoxybenzene,1,2-difluor-4-methoxybenzol,pubchem3457,3,4-difluoro-anisole,difluorobenzene,1-methoxy,acmc-2099pe PubChem CID: 568250 IUPAC Name: 1,2-difluoro-4-methoxybenzene SMILES: COC1=CC(=C(C=C1)F)F

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Specifications

PubChem CID	568250
CAS	115144-40-6
Molecular Weight (g/mol)	144.121
MDL Number	MFCD00010730
SMILES	COC1=CC(=C(C=C1)F)F
Synonym	3,4-difluoroanisole,1,2-difluoro-4-methoxy-benzene,benzene, 1,2-difluoro-4-methoxy,3,4-difluoro-1-methoxybenzene,1,2-difluor-4-methoxybenzol,pubchem3457,3,4-difluoro-anisole,difluorobenzene,1-methoxy,acmc-2099pe
IUPAC Name	1,2-difluoro-4-methoxybenzene
InChI Key	DSEVNUCNUTYYHW-UHFFFAOYSA-N
Molecular Formula	C7H6F2O

6,537

4-Methoxyphenylacetic Acid 98.0+%, TCI America™

CAS: 104-01-8 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00004345 InChI Key: NRPFNQUDKRYCNX-UHFFFAOYSA-N Synonym: 4-methoxyphenylacetic acid,homoanisic acid,2-4-methoxyphenyl acetic acid,4-methoxybenzeneacetic acid,benzeneacetic acid, 4-methoxy,4-methoxyphenyl acetic acid,p-methoxyphenylacetic acid,2-p-anisyl acetic acid,p-methoxyphenyl acetic acid PubChem CID: 7690 ChEBI: CHEBI:55501 IUPAC Name: 2-(4-methoxyphenyl)acetic acid SMILES: COC1=CC=C(C=C1)CC(=O)O

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Specifications

PubChem CID	7690
CAS	104-01-8
Molecular Weight (g/mol)	166.176
ChEBI	CHEBI:55501
MDL Number	MFCD00004345
SMILES	COC1=CC=C(C=C1)CC(=O)O
Synonym	4-methoxyphenylacetic acid,homoanisic acid,2-4-methoxyphenyl acetic acid,4-methoxybenzeneacetic acid,benzeneacetic acid, 4-methoxy,4-methoxyphenyl acetic acid,p-methoxyphenylacetic acid,2-p-anisyl acetic acid,p-methoxyphenyl acetic acid
IUPAC Name	2-(4-methoxyphenyl)acetic acid
InChI Key	NRPFNQUDKRYCNX-UHFFFAOYSA-N
Molecular Formula	C9H10O3

6,538

2-Chloro-5-fluoroanisole 97.0+%, TCI America™

CAS: 450-89-5 Molecular Formula: C7H6ClFO Molecular Weight (g/mol): 160.57 MDL Number: MFCD00042573 InChI Key: ULVPJKKERHMKLS-UHFFFAOYSA-N Synonym: 2-chloro-5-fluoroanisole,benzene, 1-chloro-4-fluoro-2-methoxy,1-chloro-4-fluoro-2-methoxy-benzene,pubchem2659,acmc-1aezg,2-chloro-5-flouroanisole,1-chloro-2-methoxy-4-fluorobenzene;2-chloro-5-fluoroanisole1-chloro-4-fluoro-2-methoxybenzene PubChem CID: 2724520 IUPAC Name: 1-chloro-4-fluoro-2-methoxybenzene SMILES: COC1=CC(F)=CC=C1Cl

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Specifications

PubChem CID	2724520
CAS	450-89-5
Molecular Weight (g/mol)	160.57
MDL Number	MFCD00042573
SMILES	COC1=CC(F)=CC=C1Cl
Synonym	2-chloro-5-fluoroanisole,benzene, 1-chloro-4-fluoro-2-methoxy,1-chloro-4-fluoro-2-methoxy-benzene,pubchem2659,acmc-1aezg,2-chloro-5-flouroanisole,1-chloro-2-methoxy-4-fluorobenzene;2-chloro-5-fluoroanisole1-chloro-4-fluoro-2-methoxybenzene
IUPAC Name	1-chloro-4-fluoro-2-methoxybenzene
InChI Key	ULVPJKKERHMKLS-UHFFFAOYSA-N
Molecular Formula	C7H6ClFO

6,539

5,8-Dibromo-2,3-bis(4-methoxyphenyl)quinoxaline 98.0+%, TCI America™

CAS: 162967-90-0 Molecular Formula: C22H16Br2N2O2 Molecular Weight (g/mol): 500.19 InChI Key: PEHOANSJGUIQOF-UHFFFAOYSA-N PubChem CID: 57712549 IUPAC Name: 5,8-dibromo-2,3-bis(4-methoxyphenyl)quinoxaline SMILES: COC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3N=C2C4=CC=C(C=C4)OC)Br)Br

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Specifications

PubChem CID	57712549
CAS	162967-90-0
Molecular Weight (g/mol)	500.19
SMILES	COC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3N=C2C4=CC=C(C=C4)OC)Br)Br
IUPAC Name	5,8-dibromo-2,3-bis(4-methoxyphenyl)quinoxaline
InChI Key	PEHOANSJGUIQOF-UHFFFAOYSA-N
Molecular Formula	C22H16Br2N2O2

6,540

1-Ethyl-4-[(4-methoxyphenyl)ethynyl]benzene 98.0+%, TCI America™

CAS: 63221-88-5 Molecular Formula: C17H16O Molecular Weight (g/mol): 236.31 MDL Number: MFCD00807428 InChI Key: YWDALJMLXXWXFP-UHFFFAOYSA-N Synonym: 1-ethyl-4-4-methoxyphenyl ethynyl benzene,1-4-ethylphenyl-2-4-methoxyphenyl acetylene,4-4-ethylphenyl ethynyl anisole,1-ethyl-4-2-4-methoxyphenyl ethynyl benzene,benzene,1-ethyl-4-2-4-methoxyphenyl ethynyl,1-2-4-ethylphenyl ethynyl-4-methoxybenzene,4-methoxy-4'-ethyltolane,acmc-209ne1 PubChem CID: 3952083 IUPAC Name: 1-ethyl-4-[2-(4-methoxyphenyl)ethynyl]benzene SMILES: CCC1=CC=C(C=C1)C#CC1=CC=C(OC)C=C1

Pricing & Availability
Specifications

PubChem CID	3952083
CAS	63221-88-5
Molecular Weight (g/mol)	236.31
MDL Number	MFCD00807428
SMILES	CCC1=CC=C(C=C1)C#CC1=CC=C(OC)C=C1
Synonym	1-ethyl-4-4-methoxyphenyl ethynyl benzene,1-4-ethylphenyl-2-4-methoxyphenyl acetylene,4-4-ethylphenyl ethynyl anisole,1-ethyl-4-2-4-methoxyphenyl ethynyl benzene,benzene,1-ethyl-4-2-4-methoxyphenyl ethynyl,1-2-4-ethylphenyl ethynyl-4-methoxybenzene,4-methoxy-4'-ethyltolane,acmc-209ne1
IUPAC Name	1-ethyl-4-[2-(4-methoxyphenyl)ethynyl]benzene
InChI Key	YWDALJMLXXWXFP-UHFFFAOYSA-N
Molecular Formula	C17H16O

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