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.

3,796 – 3,810 of 43,811 results

3,796

Thermo Scientific Chemicals 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

3,797

Thermo Scientific Chemicals 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

3,798

Thermo Scientific Chemicals 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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Specifications

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

3,799

Thermo Scientific Chemicals Chlorobis[4-(trifluoromethyl)phenyl]phosphine, 97%

CAS: 13685-24-0 Molecular Formula: C14H8ClF6P Molecular Weight (g/mol): 356.632 MDL Number: MFCD04972304 InChI Key: PBLUOOURLNAOAJ-UHFFFAOYSA-N Synonym: bis 4-trifluoromethylphenyl chlorophosphine,chlorobis 4-trifluoromethyl phenyl phosphine,bis 4-trifluoromethyl phenyl chlorophosphine,chlorobis 4-trifluoromethyl phenyl phosphane,acmc-20alnb,chloro-bis 4-trifluoromethyl phenyl phosphane PubChem CID: 4379933 IUPAC Name: chloro-bis[4-(trifluoromethyl)phenyl]phosphane SMILES: C1=CC(=CC=C1C(F)(F)F)P(C2=CC=C(C=C2)C(F)(F)F)Cl

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Specifications

PubChem CID	4379933
CAS	13685-24-0
Molecular Weight (g/mol)	356.632
MDL Number	MFCD04972304
SMILES	C1=CC(=CC=C1C(F)(F)F)P(C2=CC=C(C=C2)C(F)(F)F)Cl
Synonym	bis 4-trifluoromethylphenyl chlorophosphine,chlorobis 4-trifluoromethyl phenyl phosphine,bis 4-trifluoromethyl phenyl chlorophosphine,chlorobis 4-trifluoromethyl phenyl phosphane,acmc-20alnb,chloro-bis 4-trifluoromethyl phenyl phosphane
IUPAC Name	chloro-bis[4-(trifluoromethyl)phenyl]phosphane
InChI Key	PBLUOOURLNAOAJ-UHFFFAOYSA-N
Molecular Formula	C14H8ClF6P

3,800

4-Amino-2-fluorobenzoic acid, 98%, Thermo Scientific Chemicals

CAS: 446-31-1 Molecular Formula: C7H6FNO2 Molecular Weight (g/mol): 155.128 MDL Number: MFCD01569397 InChI Key: QHERSCUZBKDVOC-UHFFFAOYSA-N Synonym: 2-fluoro-4-aminobenzoic acid,4-amino-2-fluorobenzoicacid,4-amino-2-fluorobenzenecarboxylic acid,4-amino-2-fluoro-benzoic acid,4-carboxy-3-fluoroaniline,benzoic acid, 4-amino-2-fluoro,pubchem4693,acmc-209jz6,ksc237k0f,4-amino-2-fluoro benzoic acid PubChem CID: 302680 IUPAC Name: 4-amino-2-fluorobenzoic acid SMILES: C1=CC(=C(C=C1N)F)C(=O)O

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Specifications

PubChem CID	302680
CAS	446-31-1
Molecular Weight (g/mol)	155.128
MDL Number	MFCD01569397
SMILES	C1=CC(=C(C=C1N)F)C(=O)O
Synonym	2-fluoro-4-aminobenzoic acid,4-amino-2-fluorobenzoicacid,4-amino-2-fluorobenzenecarboxylic acid,4-amino-2-fluoro-benzoic acid,4-carboxy-3-fluoroaniline,benzoic acid, 4-amino-2-fluoro,pubchem4693,acmc-209jz6,ksc237k0f,4-amino-2-fluoro benzoic acid
IUPAC Name	4-amino-2-fluorobenzoic acid
InChI Key	QHERSCUZBKDVOC-UHFFFAOYSA-N
Molecular Formula	C7H6FNO2

3,801

Thermo Scientific Chemicals 2-Bromo-4-nitro-1-(trifluoromethoxy)benzene, 98%

CAS: 200958-40-3 Molecular Formula: C7H3BrF3NO3 Molecular Weight (g/mol): 286.00 MDL Number: MFCD04973758 InChI Key: LVTAFGFYMLODQP-UHFFFAOYSA-N PubChem CID: 24721641 IUPAC Name: 2-bromo-4-nitro-1-(trifluoromethoxy)benzene SMILES: [O-][N+](=O)C1=CC(Br)=C(OC(F)(F)F)C=C1

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Specifications

PubChem CID	24721641
CAS	200958-40-3
Molecular Weight (g/mol)	286.00
MDL Number	MFCD04973758
SMILES	[O-][N+](=O)C1=CC(Br)=C(OC(F)(F)F)C=C1
IUPAC Name	2-bromo-4-nitro-1-(trifluoromethoxy)benzene
InChI Key	LVTAFGFYMLODQP-UHFFFAOYSA-N
Molecular Formula	C7H3BrF3NO3

3,802

Thermo Scientific Chemicals 3-Bromo-5-(trifluoromethyl)benzaldehyde, 97%

CAS: 477535-41-4 Molecular Formula: C8H4BrF3O Molecular Weight (g/mol): 253.02 MDL Number: MFCD08059506 InChI Key: PCRLZGCXLNNMFL-UHFFFAOYSA-N Synonym: 3-bromo-5-trifluoromethyl benzaldehyde,benzaldehyde, 3-bromo-5-trifluoromethyl,3-trifluoromethyl-5-bromobenzaldehyde,3-bromo-5-trifluoromethyl-benzaldehyde,pubchem16131,acmc-209kad,ksc496e1r,3-bromo-5-formylbenzotrifluoride,5-bromo-3-trifluoromethyl benzaldehyde PubChem CID: 16115438 IUPAC Name: 3-bromo-5-(trifluoromethyl)benzaldehyde SMILES: FC(F)(F)C1=CC(Br)=CC(C=O)=C1

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Specifications

PubChem CID	16115438
CAS	477535-41-4
Molecular Weight (g/mol)	253.02
MDL Number	MFCD08059506
SMILES	FC(F)(F)C1=CC(Br)=CC(C=O)=C1
Synonym	3-bromo-5-trifluoromethyl benzaldehyde,benzaldehyde, 3-bromo-5-trifluoromethyl,3-trifluoromethyl-5-bromobenzaldehyde,3-bromo-5-trifluoromethyl-benzaldehyde,pubchem16131,acmc-209kad,ksc496e1r,3-bromo-5-formylbenzotrifluoride,5-bromo-3-trifluoromethyl benzaldehyde
IUPAC Name	3-bromo-5-(trifluoromethyl)benzaldehyde
InChI Key	PCRLZGCXLNNMFL-UHFFFAOYSA-N
Molecular Formula	C8H4BrF3O

3,803

Thermo Scientific Chemicals 2,6-Dimethyl-4-nitroanisole, 99%

CAS: 14804-39-8 Molecular Formula: C9H11NO3 Molecular Weight (g/mol): 181.19 MDL Number: MFCD00024537 InChI Key: HSDNHFOJTRMGER-UHFFFAOYSA-N Synonym: 2,6-dimethyl-4-nitroanisole,m-xylene, 2-methoxy-5-nitro,benzene,2-methoxy-1,3-dimethyl-5-nitro,acmc-20ao84,m-xylene, 2-methoxy-5-nitro-,,4-methoxy-3,5-dimethylnitrobenzene,2,6-dimethyl-1-methoxy-4-nitrobenzene,2-methoxy-1,3-di-methyl-5-nitrobenzene,benzene, 2-methoxy-1,3-dimethyl-5-nitro PubChem CID: 139835 IUPAC Name: 2-methoxy-1,3-dimethyl-5-nitrobenzene SMILES: COC1=C(C)C=C(C=C1C)[N+]([O-])=O

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Specifications

PubChem CID	139835
CAS	14804-39-8
Molecular Weight (g/mol)	181.19
MDL Number	MFCD00024537
SMILES	COC1=C(C)C=C(C=C1C)[N+]([O-])=O
Synonym	2,6-dimethyl-4-nitroanisole,m-xylene, 2-methoxy-5-nitro,benzene,2-methoxy-1,3-dimethyl-5-nitro,acmc-20ao84,m-xylene, 2-methoxy-5-nitro-,,4-methoxy-3,5-dimethylnitrobenzene,2,6-dimethyl-1-methoxy-4-nitrobenzene,2-methoxy-1,3-di-methyl-5-nitrobenzene,benzene, 2-methoxy-1,3-dimethyl-5-nitro
IUPAC Name	2-methoxy-1,3-dimethyl-5-nitrobenzene
InChI Key	HSDNHFOJTRMGER-UHFFFAOYSA-N
Molecular Formula	C9H11NO3

3,804

Thermo Scientific Chemicals 2-Bromo-4-fluoro-6-(trifluoromethyl)aniline, 98%

CAS: 875664-27-0 Molecular Formula: C7H4BrF4N Molecular Weight (g/mol): 258.014 MDL Number: MFCD04973756 InChI Key: OTYCOVZULSPPPW-UHFFFAOYSA-N Synonym: 2-bromo-4-fluoro-6-trifluoromethyl aniline,2-amino-3-bromo-5-fluorobenzotrifluoride,buttpark 154\11-38,benzenamine,2-bromo-4-fluoro-6-trifluoromethyl,2-bromo-4-fluoro-6-trifluoromethyl benzenamine,pubchem19869,ksc658m8n,2-bromo-4-fluoro-6-trifluoromethyl phenylamine,6-bromo-4-fluoro-2-trifluoromethyl phenylamine,2-bromanyl-4-fluoranyl-6-trifluoromethyl aniline PubChem CID: 7018045 IUPAC Name: 2-bromo-4-fluoro-6-(trifluoromethyl)aniline SMILES: C1=C(C=C(C(=C1Br)N)C(F)(F)F)F

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Specifications

PubChem CID	7018045
CAS	875664-27-0
Molecular Weight (g/mol)	258.014
MDL Number	MFCD04973756
SMILES	C1=C(C=C(C(=C1Br)N)C(F)(F)F)F
Synonym	2-bromo-4-fluoro-6-trifluoromethyl aniline,2-amino-3-bromo-5-fluorobenzotrifluoride,buttpark 154\11-38,benzenamine,2-bromo-4-fluoro-6-trifluoromethyl,2-bromo-4-fluoro-6-trifluoromethyl benzenamine,pubchem19869,ksc658m8n,2-bromo-4-fluoro-6-trifluoromethyl phenylamine,6-bromo-4-fluoro-2-trifluoromethyl phenylamine,2-bromanyl-4-fluoranyl-6-trifluoromethyl aniline
IUPAC Name	2-bromo-4-fluoro-6-(trifluoromethyl)aniline
InChI Key	OTYCOVZULSPPPW-UHFFFAOYSA-N
Molecular Formula	C7H4BrF4N

3,805

4'-n-Octylbiphenyl-4-carbonitrile, 99%, Thermo Scientific Chemicals

CAS: 52709-84-9 Molecular Formula: C21H25N Molecular Weight (g/mol): 291.44 MDL Number: MFCD00075146 InChI Key: CSQPODPWWMOTIY-UHFFFAOYSA-N Synonym: 4-cyano-4'-octylbiphenyl,4'-octyl-1,1'-biphenyl-4-carbonitrile,4-4-octylphenyl benzonitrile,1,1'-biphenyl-4-carbonitrile, 4'-octyl,4-octylcyanodiphenyl,k 24 liquid crystal,cb 8,4'-octyl-4-biphenylcarbonitrile,4'-octyl 1,1'-biphenyl-4-carbonitrile,4-octyl-4'-cyanobiphenyl PubChem CID: 104289 IUPAC Name: 4-(4-octylphenyl)benzonitrile SMILES: CCCCCCCCC1=CC=C(C=C1)C1=CC=C(C=C1)C#N

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Specifications

PubChem CID	104289
CAS	52709-84-9
Molecular Weight (g/mol)	291.44
MDL Number	MFCD00075146
SMILES	CCCCCCCCC1=CC=C(C=C1)C1=CC=C(C=C1)C#N
Synonym	4-cyano-4'-octylbiphenyl,4'-octyl-1,1'-biphenyl-4-carbonitrile,4-4-octylphenyl benzonitrile,1,1'-biphenyl-4-carbonitrile, 4'-octyl,4-octylcyanodiphenyl,k 24 liquid crystal,cb 8,4'-octyl-4-biphenylcarbonitrile,4'-octyl 1,1'-biphenyl-4-carbonitrile,4-octyl-4'-cyanobiphenyl
IUPAC Name	4-(4-octylphenyl)benzonitrile
InChI Key	CSQPODPWWMOTIY-UHFFFAOYSA-N
Molecular Formula	C21H25N

3,806

Thermo Scientific Chemicals 2-Bromo-5-fluoroanisole, 97%

CAS: 450-88-4 Molecular Formula: C7H6BrFO Molecular Weight (g/mol): 205.03 MDL Number: MFCD04973752 InChI Key: KGYXKRGMSUHYCY-UHFFFAOYSA-N Synonym: 2-bromo-5-fluoroanisole,benzene, 1-bromo-4-fluoro-2-methoxy,1-bromo-4-fluoro-2-methoxy-benzene,2-methoxy-4-fluorobromobenzene,buttpark 87\07-62,pubchem4091,acmc-1ct2m,ksc494a1p,bromo-4-fluoro-2-methoxybenzene PubChem CID: 7018043 IUPAC Name: 1-bromo-4-fluoro-2-methoxybenzene SMILES: COC1=CC(F)=CC=C1Br

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Specifications

PubChem CID	7018043
CAS	450-88-4
Molecular Weight (g/mol)	205.03
MDL Number	MFCD04973752
SMILES	COC1=CC(F)=CC=C1Br
Synonym	2-bromo-5-fluoroanisole,benzene, 1-bromo-4-fluoro-2-methoxy,1-bromo-4-fluoro-2-methoxy-benzene,2-methoxy-4-fluorobromobenzene,buttpark 87\07-62,pubchem4091,acmc-1ct2m,ksc494a1p,bromo-4-fluoro-2-methoxybenzene
IUPAC Name	1-bromo-4-fluoro-2-methoxybenzene
InChI Key	KGYXKRGMSUHYCY-UHFFFAOYSA-N
Molecular Formula	C7H6BrFO

3,807

4-Trifluoromethyl-alpha-toluenesulfonyl chloride, 97%, Thermo Scientific Chemicals

CAS: 163295-75-8 Molecular Formula: C8H6ClF3O2S Molecular Weight (g/mol): 258.64 MDL Number: MFCD01631932 InChI Key: KKBNUPMMAGEQAT-UHFFFAOYSA-N Synonym: 4-trifluoromethyl phenyl methanesulfonyl chloride,4-trifluoromethylbenzylsulfonyl chloride,4-trifluoromethyl benzylsulfonyl chloride,4-trifluoromethyl phenyl methyl sulfonyl chloride,4-chlorosulphonyl methyl benzotrifluoride,4-trifluoromethyl-alpha-toluenesulfonyl chloride,4-trifluoromethylphenyl methanesulfonyl chloride,4-trifluoromethyl-phenyl-methanesulfonyl chloride,alpha-chlorosulphonyl-4-trifluoromethyl toluene PubChem CID: 594332 IUPAC Name: [4-(trifluoromethyl)phenyl]methanesulfonyl chloride SMILES: FC(F)(F)C1=CC=C(CS(Cl)(=O)=O)C=C1

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Specifications

PubChem CID	594332
CAS	163295-75-8
Molecular Weight (g/mol)	258.64
MDL Number	MFCD01631932
SMILES	FC(F)(F)C1=CC=C(CS(Cl)(=O)=O)C=C1
Synonym	4-trifluoromethyl phenyl methanesulfonyl chloride,4-trifluoromethylbenzylsulfonyl chloride,4-trifluoromethyl benzylsulfonyl chloride,4-trifluoromethyl phenyl methyl sulfonyl chloride,4-chlorosulphonyl methyl benzotrifluoride,4-trifluoromethyl-alpha-toluenesulfonyl chloride,4-trifluoromethylphenyl methanesulfonyl chloride,4-trifluoromethyl-phenyl-methanesulfonyl chloride,alpha-chlorosulphonyl-4-trifluoromethyl toluene
IUPAC Name	[4-(trifluoromethyl)phenyl]methanesulfonyl chloride
InChI Key	KKBNUPMMAGEQAT-UHFFFAOYSA-N
Molecular Formula	C8H6ClF3O2S

3,808

Thermo Scientific Chemicals 2,4-Difluoro-3-methoxyaniline, 97%

CAS: 886499-08-7 Molecular Formula: C7H7F2NO Molecular Weight (g/mol): 159.14 MDL Number: MFCD04115929 InChI Key: ISMLABQIDHXORP-UHFFFAOYSA-N Synonym: 2,4-difluoro-3-methoxyphenylamine,2,4-difluoro-3-methoxy-aniline,benzenamine, 2,4-difluoro-3-methoxy PubChem CID: 3865162 IUPAC Name: 2,4-difluoro-3-methoxyaniline SMILES: COC1=C(F)C=CC(N)=C1F

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Specifications

PubChem CID	3865162
CAS	886499-08-7
Molecular Weight (g/mol)	159.14
MDL Number	MFCD04115929
SMILES	COC1=C(F)C=CC(N)=C1F
Synonym	2,4-difluoro-3-methoxyphenylamine,2,4-difluoro-3-methoxy-aniline,benzenamine, 2,4-difluoro-3-methoxy
IUPAC Name	2,4-difluoro-3-methoxyaniline
InChI Key	ISMLABQIDHXORP-UHFFFAOYSA-N
Molecular Formula	C7H7F2NO

3,809

Thermo Scientific Chemicals 4-Chloro-2,6-difluorobenzoic acid, 97%

CAS: 196194-58-8 Molecular Formula: C7H3ClF2O2 Molecular Weight (g/mol): 192.546 MDL Number: MFCD06203570 InChI Key: ZCJKTGPZLLGECQ-UHFFFAOYSA-N PubChem CID: 17750684 IUPAC Name: 4-chloro-2,6-difluorobenzoic acid SMILES: C1=C(C=C(C(=C1F)C(=O)O)F)Cl

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Specifications

PubChem CID	17750684
CAS	196194-58-8
Molecular Weight (g/mol)	192.546
MDL Number	MFCD06203570
SMILES	C1=C(C=C(C(=C1F)C(=O)O)F)Cl
IUPAC Name	4-chloro-2,6-difluorobenzoic acid
InChI Key	ZCJKTGPZLLGECQ-UHFFFAOYSA-N
Molecular Formula	C7H3ClF2O2

3,810

Thermo Scientific Chemicals 2,6-Difluoro-3-methoxyaniline, 97%

CAS: 144851-62-7 Molecular Formula: C7H7F2NO Molecular Weight (g/mol): 159.14 MDL Number: MFCD04115898 InChI Key: XVLHUQRLEPQGDI-UHFFFAOYSA-N Synonym: benzenamine,2,6-difluoro-3-methoxy,acmc-20dww5,2,6-difluoro-m-anisidine,3-amino-2,4-difluoroanisole,2,6-difluoro-3-methoxyphenylamine,benzenamine, 2,6-difluoro-3-methoxy-9ci PubChem CID: 3871278 IUPAC Name: 2,6-difluoro-3-methoxyaniline SMILES: COC1=C(F)C(N)=C(F)C=C1

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Specifications

PubChem CID	3871278
CAS	144851-62-7
Molecular Weight (g/mol)	159.14
MDL Number	MFCD04115898
SMILES	COC1=C(F)C(N)=C(F)C=C1
Synonym	benzenamine,2,6-difluoro-3-methoxy,acmc-20dww5,2,6-difluoro-m-anisidine,3-amino-2,4-difluoroanisole,2,6-difluoro-3-methoxyphenylamine,benzenamine, 2,6-difluoro-3-methoxy-9ci
IUPAC Name	2,6-difluoro-3-methoxyaniline
InChI Key	XVLHUQRLEPQGDI-UHFFFAOYSA-N
Molecular Formula	C7H7F2NO

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