Boronic acid derivatives

Organic compounds that are derived from boronic acid; boronic acid is an oxyacid of boron with the following structure: H2BOH.

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Phenylboronic acid, 98+%, may contain varying amounts of anhydride

CAS: 98-80-6 Molecular Formula: C6H7BO2 Molecular Weight (g/mol): 121.93 MDL Number: MFCD00002103 InChI Key: HXITXNWTGFUOAU-UHFFFAOYSA-N Synonym: benzeneboronic acid,boronic acid, phenyl,phenyl boronic acid,phenylboric acid,dihydroxyphenylborane,phenyldihydroxyborane,dihydroxy phenyl borane,phenylboronicacid,borophenylic acid,usaf bo-2 PubChem CID: 66827 ChEBI: CHEBI:44923 IUPAC Name: phenylboronic acid SMILES: OB(O)C1=CC=CC=C1

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PubChem CID	66827
CAS	98-80-6
Molecular Weight (g/mol)	121.93
ChEBI	CHEBI:44923
MDL Number	MFCD00002103
SMILES	OB(O)C1=CC=CC=C1
Synonym	benzeneboronic acid,boronic acid, phenyl,phenyl boronic acid,phenylboric acid,dihydroxyphenylborane,phenyldihydroxyborane,dihydroxy phenyl borane,phenylboronicacid,borophenylic acid,usaf bo-2
IUPAC Name	phenylboronic acid
InChI Key	HXITXNWTGFUOAU-UHFFFAOYSA-N
Molecular Formula	C6H7BO2

1-Butylboronic acid, 98%

CAS: 4426-47-5 Molecular Formula: C4H11BO2 Molecular Weight (g/mol): 101.94 MDL Number: MFCD00002106 InChI Key: QPKFVRWIISEVCW-UHFFFAOYSA-N Synonym: n-butylboronic acid,1-butylboronic acid,1-butaneboronic acid,n-butaneboronic acid,boronic acid, butyl,1-butane boronic acid,butylboric acid,butyl boronic acid,chembl31962,1-butyldihydroxyborane PubChem CID: 20479 IUPAC Name: butylboronic acid SMILES: CCCCB(O)O

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Specifications

PubChem CID	20479
CAS	4426-47-5
Molecular Weight (g/mol)	101.94
MDL Number	MFCD00002106
SMILES	CCCCB(O)O
Synonym	n-butylboronic acid,1-butylboronic acid,1-butaneboronic acid,n-butaneboronic acid,boronic acid, butyl,1-butane boronic acid,butylboric acid,butyl boronic acid,chembl31962,1-butyldihydroxyborane
IUPAC Name	butylboronic acid
InChI Key	QPKFVRWIISEVCW-UHFFFAOYSA-N
Molecular Formula	C4H11BO2

Pyridine-3-boronic acid

CAS: 1692-25-7 Molecular Formula: C5H6BNO2 Molecular Weight (g/mol): 122.92 MDL Number: MFCD00674177 InChI Key: ABMYEXAYWZJVOV-UHFFFAOYSA-N Synonym: pyridine-3-boronic acid,3-pyridylboronic acid,3-pyridineboronic acid,pyridin-3-yl boronic acid,3-pyridinylboronic acid,pyridin-3-yl-3-boronic acid,3-pyridineboric acid,3-pyridinebornic acid,pyridyl-3-boronic acid,pyridine 3-boronic acid PubChem CID: 2734378 IUPAC Name: pyridin-3-ylboronic acid SMILES: OB(O)C1=CC=CN=C1

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PubChem CID	2734378
CAS	1692-25-7
Molecular Weight (g/mol)	122.92
MDL Number	MFCD00674177
SMILES	OB(O)C1=CC=CN=C1
Synonym	pyridine-3-boronic acid,3-pyridylboronic acid,3-pyridineboronic acid,pyridin-3-yl boronic acid,3-pyridinylboronic acid,pyridin-3-yl-3-boronic acid,3-pyridineboric acid,3-pyridinebornic acid,pyridyl-3-boronic acid,pyridine 3-boronic acid
IUPAC Name	pyridin-3-ylboronic acid
InChI Key	ABMYEXAYWZJVOV-UHFFFAOYSA-N
Molecular Formula	C5H6BNO2

PubChem CID	66827
CAS	98-80-6
Molecular Weight (g/mol)	121.93
ChEBI	CHEBI:44923
MDL Number	MFCD00002103
SMILES	OB(O)C1=CC=CC=C1
Synonym	benzeneboronic acid,boronic acid, phenyl,phenyl boronic acid,phenylboric acid,dihydroxyphenylborane,phenyldihydroxyborane,dihydroxy phenyl borane,phenylboronicacid,borophenylic acid,usaf bo-2
IUPAC Name	phenylboronic acid
InChI Key	HXITXNWTGFUOAU-UHFFFAOYSA-N
Molecular Formula	C6H7BO2

1-Naphthaleneboronic acid, 97%

CAS: 13922-41-3 Molecular Formula: C10H9BO2 Molecular Weight (g/mol): 171.99 MDL Number: MFCD00019722 InChI Key: HUMMCEUVDBVXTQ-UHFFFAOYSA-N Synonym: 1-naphthaleneboronic acid,1-naphthylboronic acid,naphthalene-1-boronic acid,naphthalenyl-1-boronic acid,1-naphthalene boronic acid,1-naphthaleneboronicacid,1-naphthyleneboronic acid,boronic acid, naphthalenyl,1-borononaphthalene,naphthylboronic acid PubChem CID: 254532 IUPAC Name: naphthalen-1-ylboronic acid SMILES: OB(O)C1=CC=CC2=CC=CC=C12

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Specifications

PubChem CID	254532
CAS	13922-41-3
Molecular Weight (g/mol)	171.99
MDL Number	MFCD00019722
SMILES	OB(O)C1=CC=CC2=CC=CC=C12
Synonym	1-naphthaleneboronic acid,1-naphthylboronic acid,naphthalene-1-boronic acid,naphthalenyl-1-boronic acid,1-naphthalene boronic acid,1-naphthaleneboronicacid,1-naphthyleneboronic acid,boronic acid, naphthalenyl,1-borononaphthalene,naphthylboronic acid
IUPAC Name	naphthalen-1-ylboronic acid
InChI Key	HUMMCEUVDBVXTQ-UHFFFAOYSA-N
Molecular Formula	C10H9BO2

1,4-Benzenediboronic acid, 96%

CAS: 4612-26-4 Molecular Formula: C6H8B2O4 Molecular Weight (g/mol): 165.746 MDL Number: MFCD00236018 InChI Key: BODYVHJTUHHINQ-UHFFFAOYSA-N Synonym: 1,4-benzenediboronic acid,1,4-phenylenediboronic acid,1,4-phenylenebisboronic acid,benzene-1,4-diboronic acid,4-boronophenyl boronic acid,p-benzenediboronic acid,p-phenylenediboronic acid,1,4-phenylenebis boronic acid,1,4 phenyl diboronic acid,boronic acid, 1,4-phenylenebis PubChem CID: 230478 IUPAC Name: (4-boronophenyl)boronic acid SMILES: B(C1=CC=C(C=C1)B(O)O)(O)O

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Specifications

PubChem CID	230478
CAS	4612-26-4
Molecular Weight (g/mol)	165.746
MDL Number	MFCD00236018
SMILES	B(C1=CC=C(C=C1)B(O)O)(O)O
Synonym	1,4-benzenediboronic acid,1,4-phenylenediboronic acid,1,4-phenylenebisboronic acid,benzene-1,4-diboronic acid,4-boronophenyl boronic acid,p-benzenediboronic acid,p-phenylenediboronic acid,1,4-phenylenebis boronic acid,1,4 phenyl diboronic acid,boronic acid, 1,4-phenylenebis
IUPAC Name	(4-boronophenyl)boronic acid
InChI Key	BODYVHJTUHHINQ-UHFFFAOYSA-N
Molecular Formula	C6H8B2O4

(2-Methylpropyl)boronic acid, 95+%

CAS: 84110-40-7 Molecular Formula: C4H11BO2 Molecular Weight (g/mol): 101.94 MDL Number: MFCD00134156 InChI Key: ZAZPDOYUCVFPOI-UHFFFAOYSA-N Synonym: isobutylboronic acid,isobutaneboronic acid,2-methylpropyl boronic acid,1-isobutaneboronic acid,2-methylpropaneboronic acid,2-methylprop-1-ylboronic acid,unii-khx76h7jhz,khx76h7jhz,2-methyl-1-propylboronic acid,2-methyl-1-propaneboronic acid PubChem CID: 2734395 IUPAC Name: 2-methylpropylboronic acid SMILES: CC(C)CB(O)O

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Specifications

PubChem CID	2734395
CAS	84110-40-7
Molecular Weight (g/mol)	101.94
MDL Number	MFCD00134156
SMILES	CC(C)CB(O)O
Synonym	isobutylboronic acid,isobutaneboronic acid,2-methylpropyl boronic acid,1-isobutaneboronic acid,2-methylpropaneboronic acid,2-methylprop-1-ylboronic acid,unii-khx76h7jhz,khx76h7jhz,2-methyl-1-propylboronic acid,2-methyl-1-propaneboronic acid
IUPAC Name	2-methylpropylboronic acid
InChI Key	ZAZPDOYUCVFPOI-UHFFFAOYSA-N
Molecular Formula	C4H11BO2

n-Butylboronic acid, 98%

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Specifications

PubChem CID	20479
CAS	4426-47-5
Molecular Weight (g/mol)	101.94
MDL Number	MFCD00002106
SMILES	CCCCB(O)O
Synonym	n-butylboronic acid,1-butylboronic acid,1-butaneboronic acid,n-butaneboronic acid,boronic acid, butyl,1-butane boronic acid,butylboric acid,butyl boronic acid,chembl31962,1-butyldihydroxyborane
IUPAC Name	butylboronic acid
InChI Key	QPKFVRWIISEVCW-UHFFFAOYSA-N
Molecular Formula	C4H11BO2

4-Nitrophenylboronic acid, 97%

CAS: 24067-17-2 Molecular Formula: C6H6BNO4 Molecular Weight (g/mol): 166.93 MDL Number: MFCD00161360 InChI Key: NSFJAFZHYOAMHL-UHFFFAOYSA-N Synonym: 4-nitrophenyl boronic acid,4-nitrobenzeneboronic acid,p-nitrophenylboronic acid,4-nitrophenylboronicacid,p-nitrophenyl boronic acid,4-nitro phenyl boronic acid,boronic acid, 4-nitrophenyl,boronic acid, b-4-nitrophenyl,4-borononitrobenzene PubChem CID: 2773552 IUPAC Name: (4-nitrophenyl)boronic acid SMILES: OB(O)C1=CC=C(C=C1)[N+]([O-])=O

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Specifications

PubChem CID	2773552
CAS	24067-17-2
Molecular Weight (g/mol)	166.93
MDL Number	MFCD00161360
SMILES	OB(O)C1=CC=C(C=C1)[N+]([O-])=O
Synonym	4-nitrophenyl boronic acid,4-nitrobenzeneboronic acid,p-nitrophenylboronic acid,4-nitrophenylboronicacid,p-nitrophenyl boronic acid,4-nitro phenyl boronic acid,boronic acid, 4-nitrophenyl,boronic acid, b-4-nitrophenyl,4-borononitrobenzene
IUPAC Name	(4-nitrophenyl)boronic acid
InChI Key	NSFJAFZHYOAMHL-UHFFFAOYSA-N
Molecular Formula	C6H6BNO4

4-Methoxybenzeneboronic acid, 97+%

CAS: 5720-07-0 Molecular Formula: C7H9BO3 Molecular Weight (g/mol): 151.96 MDL Number: MFCD00039139 InChI Key: VOAAEKKFGLPLLU-UHFFFAOYSA-N Synonym: 4-methoxyphenyl boronic acid,4-methoxybenzeneboronic acid,p-anisylboronic acid,p-methoxyphenylboronic acid,p-methoxybenzeneboronic acid,4-methoxyphenyl boranediol,benzeneboronic acid, p-methoxy,4-boronoanisole,4-methoxyphenylboronicacid PubChem CID: 201262 IUPAC Name: (4-methoxyphenyl)boronic acid SMILES: COC1=CC=C(C=C1)B(O)O

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Specifications

PubChem CID	201262
CAS	5720-07-0
Molecular Weight (g/mol)	151.96
MDL Number	MFCD00039139
SMILES	COC1=CC=C(C=C1)B(O)O
Synonym	4-methoxyphenyl boronic acid,4-methoxybenzeneboronic acid,p-anisylboronic acid,p-methoxyphenylboronic acid,p-methoxybenzeneboronic acid,4-methoxyphenyl boranediol,benzeneboronic acid, p-methoxy,4-boronoanisole,4-methoxyphenylboronicacid
IUPAC Name	(4-methoxyphenyl)boronic acid
InChI Key	VOAAEKKFGLPLLU-UHFFFAOYSA-N
Molecular Formula	C7H9BO3

4-Carboxyphenylboronic acid, 97%

CAS: 14047-29-1 Molecular Formula: C7H7BO4 Molecular Weight (g/mol): 165.94 MDL Number: MFCD00151801 InChI Key: SIAVMDKGVRXFAX-UHFFFAOYSA-N Synonym: 4-carboxyphenylboronic acid,4-carboxybenzeneboronic acid,4-dihydroxyboranyl benzoic acid,benzoic acid, 4-borono,4-dihydroxyboryl benzoic acid,p-carboxyphenylboronic acid,4-phenylester boronic acid,4-carboxyphenyl boronic acid,chembl82324 PubChem CID: 312183 IUPAC Name: 4-boronobenzoic acid SMILES: OB(O)C1=CC=C(C=C1)C(O)=O

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Specifications

PubChem CID	312183
CAS	14047-29-1
Molecular Weight (g/mol)	165.94
MDL Number	MFCD00151801
SMILES	OB(O)C1=CC=C(C=C1)C(O)=O
Synonym	4-carboxyphenylboronic acid,4-carboxybenzeneboronic acid,4-dihydroxyboranyl benzoic acid,benzoic acid, 4-borono,4-dihydroxyboryl benzoic acid,p-carboxyphenylboronic acid,4-phenylester boronic acid,4-carboxyphenyl boronic acid,chembl82324
IUPAC Name	4-boronobenzoic acid
InChI Key	SIAVMDKGVRXFAX-UHFFFAOYSA-N
Molecular Formula	C7H7BO4

2-Fluoro-6-methoxybenzeneboronic acid, 98%

CAS: 78495-63-3 Molecular Formula: C7H8BFO3 Molecular Weight (g/mol): 169.946 MDL Number: MFCD02179483 InChI Key: XOVMDVZAWWQSDC-UHFFFAOYSA-N Synonym: 2-fluoro-6-methoxybenzeneboronic acid,2-fluoro-6-methoxyphenyl boronic acid,2-fluoro-6-methoxyphenylboronicacid,6-fluoro-2-methoxyphenylboronic acid,3-fluoroanisole-2-boronic acid,boronic acid, 2-fluoro-6-methoxyphenyl,2-fluoro-6-methyloxyphenylboronic acid,boronic acid, b-2-fluoro-6-methoxyphenyl,2-fluoro-6-methoxy-phenyl boronic acid,acmc-209pef PubChem CID: 3294524 IUPAC Name: (2-fluoro-6-methoxyphenyl)boronic acid SMILES: B(C1=C(C=CC=C1F)OC)(O)O

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Specifications

PubChem CID	3294524
CAS	78495-63-3
Molecular Weight (g/mol)	169.946
MDL Number	MFCD02179483
SMILES	B(C1=C(C=CC=C1F)OC)(O)O
Synonym	2-fluoro-6-methoxybenzeneboronic acid,2-fluoro-6-methoxyphenyl boronic acid,2-fluoro-6-methoxyphenylboronicacid,6-fluoro-2-methoxyphenylboronic acid,3-fluoroanisole-2-boronic acid,boronic acid, 2-fluoro-6-methoxyphenyl,2-fluoro-6-methyloxyphenylboronic acid,boronic acid, b-2-fluoro-6-methoxyphenyl,2-fluoro-6-methoxy-phenyl boronic acid,acmc-209pef
IUPAC Name	(2-fluoro-6-methoxyphenyl)boronic acid
InChI Key	XOVMDVZAWWQSDC-UHFFFAOYSA-N
Molecular Formula	C7H8BFO3

1-Propylboronic acid, 98%

CAS: 17745-45-8 Molecular Formula: C3H9BO2 Molecular Weight (g/mol): 87.91 MDL Number: MFCD01074564 InChI Key: JAQOMSTTXPGKTN-UHFFFAOYSA-N Synonym: n-propylboronic acid,1-propaneboronic acid,propaneboronic acid,boronic acid, propyl,1-propylboronic acid,1-propaneboronic,n-propylboronc acd,propyl boronic acid,pubchem6019 PubChem CID: 351065 IUPAC Name: propylboronic acid SMILES: CCCB(O)O

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Specifications

PubChem CID	351065
CAS	17745-45-8
Molecular Weight (g/mol)	87.91
MDL Number	MFCD01074564
SMILES	CCCB(O)O
Synonym	n-propylboronic acid,1-propaneboronic acid,propaneboronic acid,boronic acid, propyl,1-propylboronic acid,1-propaneboronic,n-propylboronc acd,propyl boronic acid,pubchem6019
IUPAC Name	propylboronic acid
InChI Key	JAQOMSTTXPGKTN-UHFFFAOYSA-N
Molecular Formula	C3H9BO2

2-Tolylboronic acid, 95%

CAS: 16419-60-6 Molecular Formula: C7H9BO2 Molecular Weight (g/mol): 135.96 MDL Number: MFCD00093526 InChI Key: NSJVYHOPHZMZPN-UHFFFAOYSA-N Synonym: 2-tolylboronic acid,o-tolylboronic acid,2-methylbenzeneboronic acid,2-methylphenyl boronic acid,o-methylphenylboronic acid,2-methylphenyl boranediol,tolylboronic acid,o-tolueneboronic acid,toluene-2-boronic acid,boronic acid, methylphenyl PubChem CID: 2733267 IUPAC Name: (2-methylphenyl)boronic acid SMILES: CC1=CC=CC=C1B(O)O

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Specifications

PubChem CID	2733267
CAS	16419-60-6
Molecular Weight (g/mol)	135.96
MDL Number	MFCD00093526
SMILES	CC1=CC=CC=C1B(O)O
Synonym	2-tolylboronic acid,o-tolylboronic acid,2-methylbenzeneboronic acid,2-methylphenyl boronic acid,o-methylphenylboronic acid,2-methylphenyl boranediol,tolylboronic acid,o-tolueneboronic acid,toluene-2-boronic acid,boronic acid, methylphenyl
IUPAC Name	(2-methylphenyl)boronic acid
InChI Key	NSJVYHOPHZMZPN-UHFFFAOYSA-N
Molecular Formula	C7H9BO2

Pyrimidine-5-boronic acid hemihydrate, 97%

CAS: 696602-91-2 Molecular Formula: C8H12B2N4O5 Molecular Weight (g/mol): 265.827 MDL Number: MFCD03002366 InChI Key: YXMKGFBYXBTOJS-UHFFFAOYSA-N Synonym: pyrimidin-5-ylboronic acid hemihydrate,pyrimidine-5-boronic acid hemihydrate,132.91 anhydrous,c4h5bn2o2.5h2o,bis pyrimidin-5-ylboronic acid hydrate PubChem CID: 67112167 IUPAC Name: pyrimidin-5-ylboronic acid;hydrate SMILES: B(C1=CN=CN=C1)(O)O.B(C1=CN=CN=C1)(O)O.O

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Specifications

PubChem CID	67112167
CAS	696602-91-2
Molecular Weight (g/mol)	265.827
MDL Number	MFCD03002366
SMILES	B(C1=CN=CN=C1)(O)O.B(C1=CN=CN=C1)(O)O.O
Synonym	pyrimidin-5-ylboronic acid hemihydrate,pyrimidine-5-boronic acid hemihydrate,132.91 anhydrous,c4h5bn2o2.5h2o,bis pyrimidin-5-ylboronic acid hydrate
IUPAC Name	pyrimidin-5-ylboronic acid;hydrate
InChI Key	YXMKGFBYXBTOJS-UHFFFAOYSA-N
Molecular Formula	C8H12B2N4O5

Boronic acid derivatives

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