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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Benzeneboronic acid, 98+%

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

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

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Specifications

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

Isobutylboronic acid, 97%

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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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

Ethylboronic acid, 97%

CAS: 4433-63-0 Molecular Formula: C2H7BO2 Molecular Weight (g/mol): 73.89 MDL Number: MFCD01074536 InChI Key: PAVZHTXVORCEHP-UHFFFAOYSA-N Synonym: boronic acid, ethyl,ethaneboronic acid,ethyldihydroxyborane,ethyl boronic acid,boronic acid, ethyl-9ci,ethylboronicacid,pubchem7960,ethylboric acid,etb oh 2 PubChem CID: 521157 IUPAC Name: ethylboronic acid SMILES: CCB(O)O

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Specifications

PubChem CID	521157
CAS	4433-63-0
Molecular Weight (g/mol)	73.89
MDL Number	MFCD01074536
SMILES	CCB(O)O
Synonym	boronic acid, ethyl,ethaneboronic acid,ethyldihydroxyborane,ethyl boronic acid,boronic acid, ethyl-9ci,ethylboronicacid,pubchem7960,ethylboric acid,etb oh 2
IUPAC Name	ethylboronic acid
InChI Key	PAVZHTXVORCEHP-UHFFFAOYSA-N
Molecular Formula	C2H7BO2

Cyclopentylboronic acid, 95%

CAS: 63076-51-7 Molecular Formula: C5H11BO2 Molecular Weight (g/mol): 113.951 MDL Number: MFCD01074541 InChI Key: VTTDFSNKIMAQTB-UHFFFAOYSA-N Synonym: cyclopentaneboronic acid,boronic acid, cyclopentyl,cylopentyl boronic acid,cyclopentylboronicacid,pubchem7792,acmc-209ncu,--paclitaxel;paclitaxel,boronic acid, b-cyclopentyl,cyclopentylboronic acid PubChem CID: 2734327 IUPAC Name: cyclopentylboronic acid SMILES: B(C1CCCC1)(O)O

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Specifications

PubChem CID	2734327
CAS	63076-51-7
Molecular Weight (g/mol)	113.951
MDL Number	MFCD01074541
SMILES	B(C1CCCC1)(O)O
Synonym	cyclopentaneboronic acid,boronic acid, cyclopentyl,cylopentyl boronic acid,cyclopentylboronicacid,pubchem7792,acmc-209ncu,--paclitaxel;paclitaxel,boronic acid, b-cyclopentyl,cyclopentylboronic acid
IUPAC Name	cyclopentylboronic acid
InChI Key	VTTDFSNKIMAQTB-UHFFFAOYSA-N
Molecular Formula	C5H11BO2

4-Cyanobenzeneboronic acid, 98%

CAS: 126747-14-6 Molecular Formula: C7H6BNO2 Molecular Weight (g/mol): 146.94 MDL Number: MFCD01318968 InChI Key: CEBAHYWORUOILU-UHFFFAOYSA-N Synonym: 4-cyanophenyl boronic acid,4-cyanobenzeneboronic acid,4-dihydroxyboranyl benzonitrile,4-cyano-phenyl-boronic acid,4-boronobenzonitrile,p-cyanophenylboronic acid,4-cyanobenzene boronic acid,boronic acid, 4-cyanophenyl,4-cyano-phenyl boronic acid PubChem CID: 2734326 IUPAC Name: (4-cyanophenyl)boronic acid SMILES: OB(O)C1=CC=C(C=C1)C#N

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Specifications

PubChem CID	2734326
CAS	126747-14-6
Molecular Weight (g/mol)	146.94
MDL Number	MFCD01318968
SMILES	OB(O)C1=CC=C(C=C1)C#N
Synonym	4-cyanophenyl boronic acid,4-cyanobenzeneboronic acid,4-dihydroxyboranyl benzonitrile,4-cyano-phenyl-boronic acid,4-boronobenzonitrile,p-cyanophenylboronic acid,4-cyanobenzene boronic acid,boronic acid, 4-cyanophenyl,4-cyano-phenyl boronic acid
IUPAC Name	(4-cyanophenyl)boronic acid
InChI Key	CEBAHYWORUOILU-UHFFFAOYSA-N
Molecular Formula	C7H6BNO2

Methylboronic acid, 97%

CAS: 13061-96-6 Molecular Formula: CH5BO2 Molecular Weight (g/mol): 59.86 MDL Number: MFCD00002105 InChI Key: KTMKRRPZPWUYKK-UHFFFAOYSA-N Synonym: methaneboronic acid,methyl boronic acid,dihydroxymethylborane,boronic acid, methyl,unii-8z1me41sch,methane boronic acid,8z1me41sch,methylboronicacid,methyboronic acid,methyl-boronic acid PubChem CID: 139377 IUPAC Name: methylboronic acid SMILES: CB(O)O

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Specifications

PubChem CID	139377
CAS	13061-96-6
Molecular Weight (g/mol)	59.86
MDL Number	MFCD00002105
SMILES	CB(O)O
Synonym	methaneboronic acid,methyl boronic acid,dihydroxymethylborane,boronic acid, methyl,unii-8z1me41sch,methane boronic acid,8z1me41sch,methylboronicacid,methyboronic acid,methyl-boronic acid
IUPAC Name	methylboronic acid
InChI Key	KTMKRRPZPWUYKK-UHFFFAOYSA-N
Molecular Formula	CH5BO2

PubChem CID	521157
CAS	4433-63-0
Molecular Weight (g/mol)	73.89
MDL Number	MFCD01074536
SMILES	CCB(O)O
Synonym	boronic acid, ethyl,ethaneboronic acid,ethyldihydroxyborane,ethyl boronic acid,boronic acid, ethyl-9ci,ethylboronicacid,pubchem7960,ethylboric acid,etb oh 2
IUPAC Name	ethylboronic acid
InChI Key	PAVZHTXVORCEHP-UHFFFAOYSA-N
Molecular Formula	C2H7BO2

Methylboronic acid, 97%

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Specifications

PubChem CID	139377
CAS	13061-96-6
Molecular Weight (g/mol)	59.86
MDL Number	MFCD00002105
SMILES	CB(O)O
Synonym	methaneboronic acid,methyl boronic acid,dihydroxymethylborane,boronic acid, methyl,unii-8z1me41sch,methane boronic acid,8z1me41sch,methylboronicacid,methyboronic acid,methyl-boronic acid
IUPAC Name	methylboronic acid
InChI Key	KTMKRRPZPWUYKK-UHFFFAOYSA-N
Molecular Formula	CH5BO2

4-Isopropoxybenzeneboronic acid, 97%

CAS: 153624-46-5 Molecular Formula: C9H13BO3 Molecular Weight (g/mol): 180.01 MDL Number: MFCD03427051 InChI Key: CJUHQADBFQRIMC-UHFFFAOYSA-N Synonym: 4-isopropoxyphenylboronic acid,4-isopropoxylphenylboronic acid,4-isopropoxyphenyl boronic acid,4-isopropoxybenzeneboronic acid,4-isopropyloxyphenylboronic acid,4-propan-2-yloxyphenyl boronic acid,boronic acid, 4-1-methylethoxy phenyl,4-propan-2-yloxy phenyl boronic acid,4-iso-propoxyphenylboronic acid,p-isopropoxyphenylboronic acid PubChem CID: 3698726 IUPAC Name: (4-propan-2-yloxyphenyl)boronic acid SMILES: B(C1=CC=C(C=C1)OC(C)C)(O)O

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Specifications

PubChem CID	3698726
CAS	153624-46-5
Molecular Weight (g/mol)	180.01
MDL Number	MFCD03427051
SMILES	B(C1=CC=C(C=C1)OC(C)C)(O)O
Synonym	4-isopropoxyphenylboronic acid,4-isopropoxylphenylboronic acid,4-isopropoxyphenyl boronic acid,4-isopropoxybenzeneboronic acid,4-isopropyloxyphenylboronic acid,4-propan-2-yloxyphenyl boronic acid,boronic acid, 4-1-methylethoxy phenyl,4-propan-2-yloxy phenyl boronic acid,4-iso-propoxyphenylboronic acid,p-isopropoxyphenylboronic acid
IUPAC Name	(4-propan-2-yloxyphenyl)boronic acid
InChI Key	CJUHQADBFQRIMC-UHFFFAOYSA-N
Molecular Formula	C9H13BO3

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

n-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

4-Methylbenzeneboronic acid, 98%

CAS: 5720-05-8

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CAS	5720-05-8

1-Octylboronic acid, 97%

CAS: 28741-08-4 Molecular Formula: C8H19BO2 Molecular Weight (g/mol): 158.048 MDL Number: MFCD01074560 InChI Key: GKFRVXOKPXCXAK-UHFFFAOYSA-N Synonym: n-octylboronic acid,1-octylboronic acid,boronic acid, octyl,1-n-octaneboronic acid,boronic acid, b-octyl,caprylboronic acid,acmc-1cbf1,n-octaneboronic acid,b-octyl-boronic acid PubChem CID: 5195177 IUPAC Name: octylboronic acid SMILES: B(CCCCCCCC)(O)O

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Specifications

PubChem CID	5195177
CAS	28741-08-4
Molecular Weight (g/mol)	158.048
MDL Number	MFCD01074560
SMILES	B(CCCCCCCC)(O)O
Synonym	n-octylboronic acid,1-octylboronic acid,boronic acid, octyl,1-n-octaneboronic acid,boronic acid, b-octyl,caprylboronic acid,acmc-1cbf1,n-octaneboronic acid,b-octyl-boronic acid
IUPAC Name	octylboronic acid
InChI Key	GKFRVXOKPXCXAK-UHFFFAOYSA-N
Molecular Formula	C8H19BO2

Boronic acid derivatives

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