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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.
Hydroxybenzoic Acid Derivatives (18,478)
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3,331 – 3,345 of 64,662 results
3,331
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Fenofibrate, BP, EP, 98-102%, Spectrum™ Chemical
SDP

CAS: 49562-28-9 Molecular Formula: C20H21ClO4 Molecular Weight (g/mol): 360.83 InChI Key: YMTINGFKWWXKFG-UHFFFAOYSA-N IUPAC Name: propan-2-yl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate SMILES: CC(C)OC(=O)C(C)(C)OC1=CC=C(C=C1)C(=O)C1=CC=C(Cl)C=C1

CAS 49562-28-9
Molecular Weight (g/mol) 360.83
SMILES CC(C)OC(=O)C(C)(C)OC1=CC=C(C=C1)C(=O)C1=CC=C(Cl)C=C1
IUPAC Name propan-2-yl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate
InChI Key YMTINGFKWWXKFG-UHFFFAOYSA-N
Molecular Formula C20H21ClO4
3,332
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3-Chlorobenzoic acid, 99%

CAS: 535-80-8 Molecular Formula: C7H5ClO2 Molecular Weight (g/mol): 156.565 MDL Number: MFCD00002491 InChI Key: LULAYUGMBFYYEX-UHFFFAOYSA-N Synonym: m-chlorobenzoic acid,benzoic acid, 3-chloro,benzoic acid, m-chloro,3-chlorobenzoicacid,3-chloro-benzoic acid,m-chlorobenzoate,acido m-clorobenzoico,unii-02uoj7064k,mcba,ccris 5992 PubChem CID: 447 ChEBI: CHEBI:49410 IUPAC Name: 3-chlorobenzoic acid SMILES: C1=CC(=CC(=C1)Cl)C(=O)O

PubChem CID 447
CAS 535-80-8
Molecular Weight (g/mol) 156.565
ChEBI CHEBI:49410
MDL Number MFCD00002491
SMILES C1=CC(=CC(=C1)Cl)C(=O)O
Synonym m-chlorobenzoic acid,benzoic acid, 3-chloro,benzoic acid, m-chloro,3-chlorobenzoicacid,3-chloro-benzoic acid,m-chlorobenzoate,acido m-clorobenzoico,unii-02uoj7064k,mcba,ccris 5992
IUPAC Name 3-chlorobenzoic acid
InChI Key LULAYUGMBFYYEX-UHFFFAOYSA-N
Molecular Formula C7H5ClO2
3,333
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3-Methoxybenzylamine, 98%

CAS: 5071-96-5 Molecular Formula: C8H11NO Molecular Weight (g/mol): 137.18 MDL Number: MFCD00008115 InChI Key: GRRIMVWABNHKBX-UHFFFAOYSA-N Synonym: 3-methoxybenzylamine,m-methoxybenzylamine,3-methoxyphenyl methanamine,1-3-methoxyphenyl methanamine,benzenemethanamine, 3-methoxy,3-methoxyphenyl methylamine,benzylamine, m-methoxy,methoxybenzylamine, 3,benzenemethanamine, 3-methoxy-9ci,sz4 PubChem CID: 21156 SMILES: COC1=CC=CC(CN)=C1

PubChem CID 21156
CAS 5071-96-5
Molecular Weight (g/mol) 137.18
MDL Number MFCD00008115
SMILES COC1=CC=CC(CN)=C1
Synonym 3-methoxybenzylamine,m-methoxybenzylamine,3-methoxyphenyl methanamine,1-3-methoxyphenyl methanamine,benzenemethanamine, 3-methoxy,3-methoxyphenyl methylamine,benzylamine, m-methoxy,methoxybenzylamine, 3,benzenemethanamine, 3-methoxy-9ci,sz4
InChI Key GRRIMVWABNHKBX-UHFFFAOYSA-N
Molecular Formula C8H11NO
3,334

2-[3-(Bromomethyl)phenyl]thiophene, ≥97%, Thermo Scientific™

CAS: 85553-44-2 Molecular Formula: C11H9BrS Molecular Weight (g/mol): 253.157 MDL Number: MFCD08435867 InChI Key: JQQDEBDYUAKNGD-UHFFFAOYSA-N Synonym: 2-3-bromomethyl phenyl thiophene,3-2-thienyl benzyl bromide,2-3-bromomethyl phenyl-thiophene PubChem CID: 13150400 IUPAC Name: 2-[3-(bromomethyl)phenyl]thiophene SMILES: C1=CC(=CC(=C1)CBr)C2=CC=CS2

PubChem CID 13150400
CAS 85553-44-2
Molecular Weight (g/mol) 253.157
MDL Number MFCD08435867
SMILES C1=CC(=CC(=C1)CBr)C2=CC=CS2
Synonym 2-3-bromomethyl phenyl thiophene,3-2-thienyl benzyl bromide,2-3-bromomethyl phenyl-thiophene
IUPAC Name 2-[3-(bromomethyl)phenyl]thiophene
InChI Key JQQDEBDYUAKNGD-UHFFFAOYSA-N
Molecular Formula C11H9BrS
3,335
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4-Amino-4'-chlorodiphenyl ether, 97%

CAS: 101-79-1 Molecular Formula: C12H10ClNO Molecular Weight (g/mol): 219.67 MDL Number: MFCD00043925 InChI Key: YTISFYMPVILQRL-UHFFFAOYSA-N Synonym: 4-4-chlorophenoxy aniline,4-amino-4'-chlorodiphenyl ether,benzenamine, 4-4-chlorophenoxy,p-p-chlorophenoxy aniline,4-4-chlorophenoxy benzenamine,4-chloro-4'-aminodiphenyl ether,aniline, p-chlorophenoxy,4-amino-4-chlorodiphenyl ether,4'-chloro-4-aminobiphenyl ether,aniline, p-p-chlorophenoxy PubChem CID: 7578 IUPAC Name: 4-(4-chlorophenoxy)aniline SMILES: NC1=CC=C(OC2=CC=C(Cl)C=C2)C=C1

PubChem CID 7578
CAS 101-79-1
Molecular Weight (g/mol) 219.67
MDL Number MFCD00043925
SMILES NC1=CC=C(OC2=CC=C(Cl)C=C2)C=C1
Synonym 4-4-chlorophenoxy aniline,4-amino-4'-chlorodiphenyl ether,benzenamine, 4-4-chlorophenoxy,p-p-chlorophenoxy aniline,4-4-chlorophenoxy benzenamine,4-chloro-4'-aminodiphenyl ether,aniline, p-chlorophenoxy,4-amino-4-chlorodiphenyl ether,4'-chloro-4-aminobiphenyl ether,aniline, p-p-chlorophenoxy
IUPAC Name 4-(4-chlorophenoxy)aniline
InChI Key YTISFYMPVILQRL-UHFFFAOYSA-N
Molecular Formula C12H10ClNO
3,336
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2-Bromo-5-fluorobenzyl bromide, 97%

CAS: 112399-50-5 Molecular Formula: C7H5Br2F Molecular Weight (g/mol): 267.923 MDL Number: MFCD00042187 InChI Key: CZLWYKAZAVYQIK-UHFFFAOYSA-N Synonym: 2-bromo-5-fluorobenzyl bromide,1-bromo-2-bromomethyl-4-fluorobenzene,5-fluoro-2-bromobenzyl bromide,2-bromo-5-fluorobenzylbromide,benzene, 1-bromo-2-bromomethyl-4-fluoro,alpha,2-dibromo-5-fluorotoluene,pubchem1953,acmc-1bt22,ksc493i2h,2-bromo-5-fluoro benzyl bromide PubChem CID: 517972 IUPAC Name: 1-bromo-2-(bromomethyl)-4-fluorobenzene SMILES: C1=CC(=C(C=C1F)CBr)Br

PubChem CID 517972
CAS 112399-50-5
Molecular Weight (g/mol) 267.923
MDL Number MFCD00042187
SMILES C1=CC(=C(C=C1F)CBr)Br
Synonym 2-bromo-5-fluorobenzyl bromide,1-bromo-2-bromomethyl-4-fluorobenzene,5-fluoro-2-bromobenzyl bromide,2-bromo-5-fluorobenzylbromide,benzene, 1-bromo-2-bromomethyl-4-fluoro,alpha,2-dibromo-5-fluorotoluene,pubchem1953,acmc-1bt22,ksc493i2h,2-bromo-5-fluoro benzyl bromide
IUPAC Name 1-bromo-2-(bromomethyl)-4-fluorobenzene
InChI Key CZLWYKAZAVYQIK-UHFFFAOYSA-N
Molecular Formula C7H5Br2F
3,337
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Tris(pentafluorophenyl)borane, 95%

CAS: 1109-15-5 Molecular Formula: C18BF15 Molecular Weight (g/mol): 511.98 MDL Number: MFCD00269813 InChI Key: OBAJXDYVZBHCGT-UHFFFAOYSA-N Synonym: tris pentafluorophenyl borane,tris perfluorophenyl borane,tris pentafluorophenyl boron,tris 2,3,4,5,6-pentafluorophenyl borane,unii-i3wu5e2578,tris pentafluorophenyl-borane,borane, tris pentafluorophenyl,borane, tris 2,3,4,5,6-pentafluorophenyl,perfluorotriphenylboron,zlchem 1272 PubChem CID: 582056 IUPAC Name: tris(2,3,4,5,6-pentafluorophenyl)borane SMILES: FC1=C(F)C(F)=C(B(C2=C(F)C(F)=C(F)C(F)=C2F)C2=C(F)C(F)=C(F)C(F)=C2F)C(F)=C1F

PubChem CID 582056
CAS 1109-15-5
Molecular Weight (g/mol) 511.98
MDL Number MFCD00269813
SMILES FC1=C(F)C(F)=C(B(C2=C(F)C(F)=C(F)C(F)=C2F)C2=C(F)C(F)=C(F)C(F)=C2F)C(F)=C1F
Synonym tris pentafluorophenyl borane,tris perfluorophenyl borane,tris pentafluorophenyl boron,tris 2,3,4,5,6-pentafluorophenyl borane,unii-i3wu5e2578,tris pentafluorophenyl-borane,borane, tris pentafluorophenyl,borane, tris 2,3,4,5,6-pentafluorophenyl,perfluorotriphenylboron,zlchem 1272
IUPAC Name tris(2,3,4,5,6-pentafluorophenyl)borane
InChI Key OBAJXDYVZBHCGT-UHFFFAOYSA-N
Molecular Formula C18BF15
3,338
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Diphenyliodonium chloride, 97%

CAS: 1483-72-3 Molecular Formula: C12H10ClI Molecular Weight (g/mol): 316.57 MDL Number: MFCD00011909 InChI Key: RSJLWBUYLGJOBD-UHFFFAOYSA-M Synonym: diphenyliodonium chloride,diphenyliodanium chloride,iodonium, diphenyl-, chloride,diphenyliodoniumchloride,c12h10i.cl,iodonium, diphenyl-, chloride 1:1,acmc-1bxx9 PubChem CID: 73870 IUPAC Name: diphenyliodanium;chloride SMILES: [Cl-].[I+](C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 73870
CAS 1483-72-3
Molecular Weight (g/mol) 316.57
MDL Number MFCD00011909
SMILES [Cl-].[I+](C1=CC=CC=C1)C1=CC=CC=C1
Synonym diphenyliodonium chloride,diphenyliodanium chloride,iodonium, diphenyl-, chloride,diphenyliodoniumchloride,c12h10i.cl,iodonium, diphenyl-, chloride 1:1,acmc-1bxx9
IUPAC Name diphenyliodanium;chloride
InChI Key RSJLWBUYLGJOBD-UHFFFAOYSA-M
Molecular Formula C12H10ClI
3,339
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4-Benzyloxy-1-bromo-2-fluorobenzene, 98%

CAS: 185346-79-6 Molecular Formula: C13H10BrFO Molecular Weight (g/mol): 281.124 MDL Number: MFCD09801041 InChI Key: BYTJTXKQBSNGCL-UHFFFAOYSA-N Synonym: 4-benzyloxy-1-bromo-2-fluorobenzene,4-benzyloxy-2-fluorobromobenzene,benzene,1-bromo-2-fluoro-4-phenylmethoxy,acmc-1c1vq,benzyloxy-4-bromo-3-fluorobenzene,1-benzyloxy-4-bromo-3-fluorobenzene,benzyl 4-bromo-3-fluorophenyl ether,1-bromo-2-fluoro-4-benzyloxy benzene PubChem CID: 22273933 IUPAC Name: 1-bromo-2-fluoro-4-phenylmethoxybenzene SMILES: C1=CC=C(C=C1)COC2=CC(=C(C=C2)Br)F

PubChem CID 22273933
CAS 185346-79-6
Molecular Weight (g/mol) 281.124
MDL Number MFCD09801041
SMILES C1=CC=C(C=C1)COC2=CC(=C(C=C2)Br)F
Synonym 4-benzyloxy-1-bromo-2-fluorobenzene,4-benzyloxy-2-fluorobromobenzene,benzene,1-bromo-2-fluoro-4-phenylmethoxy,acmc-1c1vq,benzyloxy-4-bromo-3-fluorobenzene,1-benzyloxy-4-bromo-3-fluorobenzene,benzyl 4-bromo-3-fluorophenyl ether,1-bromo-2-fluoro-4-benzyloxy benzene
IUPAC Name 1-bromo-2-fluoro-4-phenylmethoxybenzene
InChI Key BYTJTXKQBSNGCL-UHFFFAOYSA-N
Molecular Formula C13H10BrFO
3,340
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2-(Diphenylphosphino)benzaldehyde oxime, 95%, Thermo Scientific Chemicals

CAS: 153358-05-5 Molecular Formula: C19H16NOP Molecular Weight (g/mol): 305.32 MDL Number: MFCD16251585 InChI Key: XHIVESUSSLEMGJ-UHFFFAOYSA-N Synonym: 2-diphenylphosphino benzaldehyde oxime,n-2-diphenylphosphino benzylidene hydroxylamine,e-n-2-diphenylphosphanyl phenyl methylidene hydroxylamine PubChem CID: 98043674 IUPAC Name: (NZ)-N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine SMILES: ON=CC1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 98043674
CAS 153358-05-5
Molecular Weight (g/mol) 305.32
MDL Number MFCD16251585
SMILES ON=CC1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1
Synonym 2-diphenylphosphino benzaldehyde oxime,n-2-diphenylphosphino benzylidene hydroxylamine,e-n-2-diphenylphosphanyl phenyl methylidene hydroxylamine
IUPAC Name (NZ)-N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine
InChI Key XHIVESUSSLEMGJ-UHFFFAOYSA-N
Molecular Formula C19H16NOP
3,341

2-chloro-5-(trifluoromethyl)benzene-1-sulfonyl chloride, 97%, Thermo Scientific™

CAS: 54090-08-3 Molecular Formula: C7H3Cl2F3O2S Molecular Weight (g/mol): 279.054 MDL Number: MFCD00052310 InChI Key: ZEYKLMDPUOVUCR-UHFFFAOYSA-N Synonym: 2-chloro-5-trifluoromethyl benzenesulfonyl chloride,2-chloro-5-trifluoromethyl benzene-1-sulfonyl chloride,2-chloro-5-trifluoromethyl benzenesulphonylchloride,2-chloro-5-trifluoromethyl benzenesulfonylchloride,chloro 2-chloro-5-trifluoromethyl phenyl sulfone,pubchem5106,acmc-209lcy,2-chloro-5-trifluoromethylbenzenesulfonylchloride,2-chloro-5-trifluoromethyl phenylsulfonyl chloride,4-chloro-3-trifluoromethylbenzene sulfonyl chloride PubChem CID: 2734274 IUPAC Name: 2-chloro-5-(trifluoromethyl)benzenesulfonyl chloride SMILES: C1=CC(=C(C=C1C(F)(F)F)S(=O)(=O)Cl)Cl

PubChem CID 2734274
CAS 54090-08-3
Molecular Weight (g/mol) 279.054
MDL Number MFCD00052310
SMILES C1=CC(=C(C=C1C(F)(F)F)S(=O)(=O)Cl)Cl
Synonym 2-chloro-5-trifluoromethyl benzenesulfonyl chloride,2-chloro-5-trifluoromethyl benzene-1-sulfonyl chloride,2-chloro-5-trifluoromethyl benzenesulphonylchloride,2-chloro-5-trifluoromethyl benzenesulfonylchloride,chloro 2-chloro-5-trifluoromethyl phenyl sulfone,pubchem5106,acmc-209lcy,2-chloro-5-trifluoromethylbenzenesulfonylchloride,2-chloro-5-trifluoromethyl phenylsulfonyl chloride,4-chloro-3-trifluoromethylbenzene sulfonyl chloride
IUPAC Name 2-chloro-5-(trifluoromethyl)benzenesulfonyl chloride
InChI Key ZEYKLMDPUOVUCR-UHFFFAOYSA-N
Molecular Formula C7H3Cl2F3O2S
3,342
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5,5'-Methylenedisalicylic acid, 95%

CAS: 122-25-8 Molecular Formula: C15H12O6 Molecular Weight (g/mol): 288.26 MDL Number: MFCD00016506 InChI Key: JWQFKVGACKJIAV-UHFFFAOYSA-N Synonym: 5,5'-methylenedisalicylic acid,5,5'-methylenebis 2-hydroxybenzoic acid,methylenebis salicylic acid,5,5-methylenebis salicylic acid,unii-2kf4fvv76n,5,5-methylenedisalicylic acid,5-3-carboxy-4-hydroxybenzyl salicylic acid,3,3'-dicarboxy-4,4'-dihydroxydiphenylmethane,4,4'-dihydroxy-3,3'-dicarboxydiphenylmethane,2kf4fvv76n PubChem CID: 67145 IUPAC Name: 5-[(3-carboxy-4-hydroxyphenyl)methyl]-2-hydroxybenzoic acid SMILES: C1=CC(=C(C=C1CC2=CC(=C(C=C2)O)C(=O)O)C(=O)O)O

PubChem CID 67145
CAS 122-25-8
Molecular Weight (g/mol) 288.26
MDL Number MFCD00016506
SMILES C1=CC(=C(C=C1CC2=CC(=C(C=C2)O)C(=O)O)C(=O)O)O
Synonym 5,5'-methylenedisalicylic acid,5,5'-methylenebis 2-hydroxybenzoic acid,methylenebis salicylic acid,5,5-methylenebis salicylic acid,unii-2kf4fvv76n,5,5-methylenedisalicylic acid,5-3-carboxy-4-hydroxybenzyl salicylic acid,3,3'-dicarboxy-4,4'-dihydroxydiphenylmethane,4,4'-dihydroxy-3,3'-dicarboxydiphenylmethane,2kf4fvv76n
IUPAC Name 5-[(3-carboxy-4-hydroxyphenyl)methyl]-2-hydroxybenzoic acid
InChI Key JWQFKVGACKJIAV-UHFFFAOYSA-N
Molecular Formula C15H12O6
3,343
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Propylbenzene, 98%

CAS: 103-65-1 Molecular Formula: C9H12 Molecular Weight (g/mol): 120.20 MDL Number: MFCD00009377 InChI Key: ODLMAHJVESYWTB-UHFFFAOYSA-N Synonym: n-propylbenzene,1-phenylpropane,phenylpropane,benzene, propyl,1-propylbenzene,isocumene,n-propyl benzene,propyl-benzene,unii-0wr86zhg2z,propylbenzene, n PubChem CID: 7668 ChEBI: CHEBI:42630 IUPAC Name: propylbenzene SMILES: CCCC1=CC=CC=C1

PubChem CID 7668
CAS 103-65-1
Molecular Weight (g/mol) 120.20
ChEBI CHEBI:42630
MDL Number MFCD00009377
SMILES CCCC1=CC=CC=C1
Synonym n-propylbenzene,1-phenylpropane,phenylpropane,benzene, propyl,1-propylbenzene,isocumene,n-propyl benzene,propyl-benzene,unii-0wr86zhg2z,propylbenzene, n
IUPAC Name propylbenzene
InChI Key ODLMAHJVESYWTB-UHFFFAOYSA-N
Molecular Formula C9H12
3,344
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(R)-(-)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetyl chloride, 98+%

CAS: 39637-99-5 Molecular Formula: C10H8ClF3O2 Molecular Weight (g/mol): 252.62 MDL Number: MFCD00044400 InChI Key: PAORVUMOXXAMPL-VIFPVBQESA-N Synonym: unii-81ut10uhv3,r---mtpa-cl,--alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,2r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,r---a-methoxy-a-trifluoromethylphenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,--mtpa-cl,--mosher's acid chloride PubChem CID: 3080792 IUPAC Name: (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride SMILES: CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F

PubChem CID 3080792
CAS 39637-99-5
Molecular Weight (g/mol) 252.62
MDL Number MFCD00044400
SMILES CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F
Synonym unii-81ut10uhv3,r---mtpa-cl,--alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,2r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,r---a-methoxy-a-trifluoromethylphenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,--mtpa-cl,--mosher's acid chloride
IUPAC Name (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride
InChI Key PAORVUMOXXAMPL-VIFPVBQESA-N
Molecular Formula C10H8ClF3O2
3,345
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3-Fluoro-2-formylbenzeneboronic acid, 95%

CAS: 871126-15-7 Molecular Formula: C7H6BFO3 Molecular Weight (g/mol): 167.93 MDL Number: MFCD10697421 InChI Key: GVHWLCYABLWGIR-UHFFFAOYSA-N Synonym: 3-fluoro-2-formylphenyl boronic acid,3-fluoro-2-formylbenzeneboronic acid,boronic acid, 3-fluoro-2-formylphenyl,acmc-209qf3,2-formyl-3-fluorophenylboranic acid,3-fluoro-2-formyl-phenyl boronic acid,3-fluoro-2-formylphenylboronic acid,boronic acid, b-3-fluoro-2-formylphenyl,contains varying amounts of anhydride PubChem CID: 53412038 IUPAC Name: (3-fluoro-2-formylphenyl)boronic acid SMILES: B(C1=C(C(=CC=C1)F)C=O)(O)O

PubChem CID 53412038
CAS 871126-15-7
Molecular Weight (g/mol) 167.93
MDL Number MFCD10697421
SMILES B(C1=C(C(=CC=C1)F)C=O)(O)O
Synonym 3-fluoro-2-formylphenyl boronic acid,3-fluoro-2-formylbenzeneboronic acid,boronic acid, 3-fluoro-2-formylphenyl,acmc-209qf3,2-formyl-3-fluorophenylboranic acid,3-fluoro-2-formyl-phenyl boronic acid,3-fluoro-2-formylphenylboronic acid,boronic acid, b-3-fluoro-2-formylphenyl,contains varying amounts of anhydride
IUPAC Name (3-fluoro-2-formylphenyl)boronic acid
InChI Key GVHWLCYABLWGIR-UHFFFAOYSA-N
Molecular Formula C7H6BFO3