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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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1

3-[Methoxy(methyl)carbamoyl]benzeneboronic acid, 97%, Alfa Aesar™

CAS: 723281-57-0 Molecular Formula: C9H12BNO4 Molecular Weight (g/mol): 209.01 MDL Number: MFCD04115699 InChI Key: IYZAWDLXZOCCSB-UHFFFAOYSA-N Synonym: 3-n,o-dimethylhydroxylaminocarbonyl phenylboronic acid,3-methoxy methyl carbamoyl phenyl boronic acid,3-methoxy methyl carbamoyl phenylboronic acid,3-borono-n-methoxy-n-methylbenzamide,n-methoxy-n-methyl 3-boronobenzamide,3-n,o-dimethylhydroxylaminocarbonyl benzeneboronic acid,3-n,o-dimethyl hydroxylaminocarbonyl phenylboronic acid,3-n ,o-dimethylhydroxylamino-carbonyl phenylboronic acid PubChem CID: 3856172 IUPAC Name: [3-[methoxy(methyl)carbamoyl]phenyl]boronic acid SMILES: CON(C)C(=O)C1=CC=CC(=C1)B(O)O

PubChem CID 3856172
CAS 723281-57-0
Molecular Weight (g/mol) 209.01
MDL Number MFCD04115699
SMILES CON(C)C(=O)C1=CC=CC(=C1)B(O)O
Synonym 3-n,o-dimethylhydroxylaminocarbonyl phenylboronic acid,3-methoxy methyl carbamoyl phenyl boronic acid,3-methoxy methyl carbamoyl phenylboronic acid,3-borono-n-methoxy-n-methylbenzamide,n-methoxy-n-methyl 3-boronobenzamide,3-n,o-dimethylhydroxylaminocarbonyl benzeneboronic acid,3-n,o-dimethyl hydroxylaminocarbonyl phenylboronic acid,3-n ,o-dimethylhydroxylamino-carbonyl phenylboronic acid
IUPAC Name [3-[methoxy(methyl)carbamoyl]phenyl]boronic acid
InChI Key IYZAWDLXZOCCSB-UHFFFAOYSA-N
Molecular Formula C9H12BNO4
2

4-[2-(Diethylamino)ethylcarbamoyl]benzeneboronic acid hydrochloride, 99%, Alfa Aesar™

CAS: 913835-46-8 Molecular Formula: C13H22BClN2O3 Molecular Weight (g/mol): 300.59 MDL Number: MFCD09027220 InChI Key: WQYCSVUEHAFRHV-UHFFFAOYSA-N Synonym: 4-2-diethylamino ethyl carbamoyl phenyl boronic acid hydrochloride,4-2-n,n-diethylaminoethyl aminocarbonyl phenylboronic acid, hcl,4-2-diethylamino ethyl carbamoyl benzeneboronic acid hydrochloride,4-2-diethylamino ethyl carbamoyl phenylboronic acid hydrochloride,4-2-diethylamino ethyl carbamoyl phenyl boronicacidhydrochloride,4-2-n,n-diethylaminoethyl aminocarbonyl phenylboronic acid hcl,4-2-diethylamino ethyl carbamoyl-phenyl boronic acid hydrochloride,4-2-n,n-diethylaminoethyl aminocarbonyl benzeneboronic acid hydrochloride,4-2-diethylamino ethyl carbamoyl phenyl boronic acid-hydrogen chloride 1/1,boronic acid,b-4-2-diethylamino ethyl amino carbonyl phenyl-,hydrochloride 1:1 PubChem CID: 44119574 IUPAC Name: [4-[2-(diethylamino)ethylcarbamoyl]phenyl]boronic acid;hydrochloride SMILES: B(C1=CC=C(C=C1)C(=O)NCCN(CC)CC)(O)O.Cl

PubChem CID 44119574
CAS 913835-46-8
Molecular Weight (g/mol) 300.59
MDL Number MFCD09027220
SMILES B(C1=CC=C(C=C1)C(=O)NCCN(CC)CC)(O)O.Cl
Synonym 4-2-diethylamino ethyl carbamoyl phenyl boronic acid hydrochloride,4-2-n,n-diethylaminoethyl aminocarbonyl phenylboronic acid, hcl,4-2-diethylamino ethyl carbamoyl benzeneboronic acid hydrochloride,4-2-diethylamino ethyl carbamoyl phenylboronic acid hydrochloride,4-2-diethylamino ethyl carbamoyl phenyl boronicacidhydrochloride,4-2-n,n-diethylaminoethyl aminocarbonyl phenylboronic acid hcl,4-2-diethylamino ethyl carbamoyl-phenyl boronic acid hydrochloride,4-2-n,n-diethylaminoethyl aminocarbonyl benzeneboronic acid hydrochloride,4-2-diethylamino ethyl carbamoyl phenyl boronic acid-hydrogen chloride 1/1,boronic acid,b-4-2-diethylamino ethyl amino carbonyl phenyl-,hydrochloride 1:1
IUPAC Name [4-[2-(diethylamino)ethylcarbamoyl]phenyl]boronic acid;hydrochloride
InChI Key WQYCSVUEHAFRHV-UHFFFAOYSA-N
Molecular Formula C13H22BClN2O3
4

Alfa Aesar™ 4-Bromo-2-chloro-5-methoxybenzeneboronic acid, 97%

CAS: 850567-94-1 Molecular Formula: C7H7BBrClO3 Molecular Weight (g/mol): 265.29 MDL Number: MFCD06659862 InChI Key: DMUAPYZFKLNZMJ-UHFFFAOYSA-N Synonym: 4-bromo-2-chloro-5-methoxyphenyl boronic acid,4-bromo-2-chloro-5-methoxy benzeneboronic acid,acmc-209q0w,b-2-chloro-4-bromo-5-methoxy-phenyl boronic acid,boronic acid,b-4-bromo-2-chloro-5-methoxyphenyl,b-4-bromo-2-chloro-5-methoxyphenyl-boronic acid,boronic acid, b-4-bromo-2-chloro-5-methoxyphenyl PubChem CID: 44118528 IUPAC Name: (4-bromo-2-chloro-5-methoxyphenyl)boronic acid SMILES: COC1=C(Br)C=C(Cl)C(=C1)B(O)O

PubChem CID 44118528
CAS 850567-94-1
Molecular Weight (g/mol) 265.29
MDL Number MFCD06659862
SMILES COC1=C(Br)C=C(Cl)C(=C1)B(O)O
Synonym 4-bromo-2-chloro-5-methoxyphenyl boronic acid,4-bromo-2-chloro-5-methoxy benzeneboronic acid,acmc-209q0w,b-2-chloro-4-bromo-5-methoxy-phenyl boronic acid,boronic acid,b-4-bromo-2-chloro-5-methoxyphenyl,b-4-bromo-2-chloro-5-methoxyphenyl-boronic acid,boronic acid, b-4-bromo-2-chloro-5-methoxyphenyl
IUPAC Name (4-bromo-2-chloro-5-methoxyphenyl)boronic acid
InChI Key DMUAPYZFKLNZMJ-UHFFFAOYSA-N
Molecular Formula C7H7BBrClO3
5

Alfa Aesar™ 4-Isopropoxy-2-methylbenzeneboronic acid, 98%

CAS: 871126-21-5 Molecular Formula: C10H15BO3 Molecular Weight (g/mol): 194.037 MDL Number: MFCD07363788 InChI Key: OEBXBUNQDNBWRP-UHFFFAOYSA-N Synonym: 4-isopropoxy-2-methylphenylboronic acid,4-isopropoxy-2-methylphenyl boronic acid,4-isopropoxy-2-methylbenzeneboronic acid,boronic acid,b-2-methyl-4-1-methylethoxy phenyl,2-methyl-4-propan-2-yloxy phenyl boronic acid,acmc-209qf7,4-isopropoxy-2-methylphenyl boronicacid,4-isopropoxy-2-methyl-phenyl boronic acid,2-methyl-4-propan-2-yl oxy phenyl boronic acid PubChem CID: 16218044 IUPAC Name: (2-methyl-4-propan-2-yloxyphenyl)boronic acid SMILES: B(C1=C(C=C(C=C1)OC(C)C)C)(O)O

PubChem CID 16218044
CAS 871126-21-5
Molecular Weight (g/mol) 194.037
MDL Number MFCD07363788
SMILES B(C1=C(C=C(C=C1)OC(C)C)C)(O)O
Synonym 4-isopropoxy-2-methylphenylboronic acid,4-isopropoxy-2-methylphenyl boronic acid,4-isopropoxy-2-methylbenzeneboronic acid,boronic acid,b-2-methyl-4-1-methylethoxy phenyl,2-methyl-4-propan-2-yloxy phenyl boronic acid,acmc-209qf7,4-isopropoxy-2-methylphenyl boronicacid,4-isopropoxy-2-methyl-phenyl boronic acid,2-methyl-4-propan-2-yl oxy phenyl boronic acid
IUPAC Name (2-methyl-4-propan-2-yloxyphenyl)boronic acid
InChI Key OEBXBUNQDNBWRP-UHFFFAOYSA-N
Molecular Formula C10H15BO3
6

Alfa Aesar™ 4-(Methoxycarbamoyl)benzeneboronic acid, 97%

CAS: 850568-17-1 Molecular Formula: C8H10BNO4 Molecular Weight (g/mol): 194.981 MDL Number: MFCD04115670 InChI Key: MZZWCLBDQROHHS-UHFFFAOYSA-N Synonym: 4-o-methylhydroxylaminocarbonyl phenylboronic acid,4-methoxycarbamoyl phenyl boronic acid,4-o-methylhydroxylaminocarbonyl benzeneboronic acid,4-methoxycarbamoyl phenylboronic acid,4-methoxycarbamoyl benzeneboronic acid,4-o-methyl hydroxylaminocarbonyl phenylboronic acid,4-o-methylhydroaminocarbonyl phenylboronic acid PubChem CID: 3379984 IUPAC Name: [4-(methoxycarbamoyl)phenyl]boronic acid SMILES: B(C1=CC=C(C=C1)C(=O)NOC)(O)O

PubChem CID 3379984
CAS 850568-17-1
Molecular Weight (g/mol) 194.981
MDL Number MFCD04115670
SMILES B(C1=CC=C(C=C1)C(=O)NOC)(O)O
Synonym 4-o-methylhydroxylaminocarbonyl phenylboronic acid,4-methoxycarbamoyl phenyl boronic acid,4-o-methylhydroxylaminocarbonyl benzeneboronic acid,4-methoxycarbamoyl phenylboronic acid,4-methoxycarbamoyl benzeneboronic acid,4-o-methyl hydroxylaminocarbonyl phenylboronic acid,4-o-methylhydroaminocarbonyl phenylboronic acid
IUPAC Name [4-(methoxycarbamoyl)phenyl]boronic acid
InChI Key MZZWCLBDQROHHS-UHFFFAOYSA-N
Molecular Formula C8H10BNO4
7

Alfa Aesar™ 4-(Methylcarbamoyl)benzeneboronic acid, 98%

CAS: 121177-82-0 Molecular Formula: C8H10BNO3 Molecular Weight (g/mol): 178.982 MDL Number: MFCD03788427 InChI Key: UWKSYZHFTGONHY-UHFFFAOYSA-N Synonym: 4-n-methylaminocarbonyl phenylboronic acid,4-methylcarbamoyl phenylboronic acid,4-methylcarbamoyl phenyl boronic acid,4-methylcarbamoyl benzeneboronic acid,boronic acid, 4-methylamino carbonyl phenyl,boronic acid,b-4-methylamino carbonyl phenyl,4-methylamino carbonyl phenylboronic acid,4-n-methylaminocarbonyl benzeneboronic acid,zlchem 836 PubChem CID: 2773526 IUPAC Name: [4-(methylcarbamoyl)phenyl]boronic acid SMILES: B(C1=CC=C(C=C1)C(=O)NC)(O)O

PubChem CID 2773526
CAS 121177-82-0
Molecular Weight (g/mol) 178.982
MDL Number MFCD03788427
SMILES B(C1=CC=C(C=C1)C(=O)NC)(O)O
Synonym 4-n-methylaminocarbonyl phenylboronic acid,4-methylcarbamoyl phenylboronic acid,4-methylcarbamoyl phenyl boronic acid,4-methylcarbamoyl benzeneboronic acid,boronic acid, 4-methylamino carbonyl phenyl,boronic acid,b-4-methylamino carbonyl phenyl,4-methylamino carbonyl phenylboronic acid,4-n-methylaminocarbonyl benzeneboronic acid,zlchem 836
IUPAC Name [4-(methylcarbamoyl)phenyl]boronic acid
InChI Key UWKSYZHFTGONHY-UHFFFAOYSA-N
Molecular Formula C8H10BNO3
9

1-Tetradecylboronic acid, Thermo Scientific™

CAS: 100888-40-2 Molecular Formula: C14H31BO2 Molecular Weight (g/mol): 242.21 MDL Number: MFCD00093676 InChI Key: MCUAMUGSKSODIJ-UHFFFAOYSA-N Synonym: n-tetradecylboronic acid,boronic acid,b-tetradecyl,tetradecylboranic acid,acmc-20eg95,tetradecaneboronic acid PubChem CID: 3528229 IUPAC Name: tetradecylboronic acid SMILES: CCCCCCCCCCCCCCB(O)O

PubChem CID 3528229
CAS 100888-40-2
Molecular Weight (g/mol) 242.21
MDL Number MFCD00093676
SMILES CCCCCCCCCCCCCCB(O)O
Synonym n-tetradecylboronic acid,boronic acid,b-tetradecyl,tetradecylboranic acid,acmc-20eg95,tetradecaneboronic acid
IUPAC Name tetradecylboronic acid
InChI Key MCUAMUGSKSODIJ-UHFFFAOYSA-N
Molecular Formula C14H31BO2
12

3-(1H-Tetrazol-5-ylcarbamoyl)benzeneboronic acid hydrochloride, 97%, Thermo Scientific™

CAS: 850567-38-3 Molecular Formula: C8H9BClN5O3 Molecular Weight (g/mol): 269.452 MDL Number: MFCD06659888 InChI Key: PWSGJXZLSYWEAJ-UHFFFAOYSA-N Synonym: 3-1h-tetrazol-5-yl carbamoyl phenyl boronic acid hydrochloride,3-1h-tetrazol-5-ylcarbamoyl benzeneboronic acid hydrochloride,3-1h-tetrazol-5-yl-carbamoyl phenylboronic acid, hcl,3-1h-tetrazol-5-yl-carbamoyl benzeneboronic acid, hcl,3-1h-1,2,3,4-tetrazol-5-yl carbamoyl phenylboronic acid hydrochloride,3-1h-tetrazol-5-yl-carbamoyl phenylboronic acid hcl,3-1h-tetrazol-5-yl-carbamoyl phenylboronic acid hydrochloride,3-1h-tetrazol-5-ylaminocarbonyl phenylboronic acid hydrochloride,3-2h-tetrazol-5-yl carbamoyl phenyl boronic acid-hydrogen chloride 1/1,3-2h-1,2,3,4-tetrazol-5-yl carbamoyl phenylboronic acid hydrochloride PubChem CID: 44119544 IUPAC Name: [3-(2H-tetrazol-5-ylcarbamoyl)phenyl]boronic acid;hydrochloride SMILES: B(C1=CC(=CC=C1)C(=O)NC2=NNN=N2)(O)O.Cl

PubChem CID 44119544
CAS 850567-38-3
Molecular Weight (g/mol) 269.452
MDL Number MFCD06659888
SMILES B(C1=CC(=CC=C1)C(=O)NC2=NNN=N2)(O)O.Cl
Synonym 3-1h-tetrazol-5-yl carbamoyl phenyl boronic acid hydrochloride,3-1h-tetrazol-5-ylcarbamoyl benzeneboronic acid hydrochloride,3-1h-tetrazol-5-yl-carbamoyl phenylboronic acid, hcl,3-1h-tetrazol-5-yl-carbamoyl benzeneboronic acid, hcl,3-1h-1,2,3,4-tetrazol-5-yl carbamoyl phenylboronic acid hydrochloride,3-1h-tetrazol-5-yl-carbamoyl phenylboronic acid hcl,3-1h-tetrazol-5-yl-carbamoyl phenylboronic acid hydrochloride,3-1h-tetrazol-5-ylaminocarbonyl phenylboronic acid hydrochloride,3-2h-tetrazol-5-yl carbamoyl phenyl boronic acid-hydrogen chloride 1/1,3-2h-1,2,3,4-tetrazol-5-yl carbamoyl phenylboronic acid hydrochloride
IUPAC Name [3-(2H-tetrazol-5-ylcarbamoyl)phenyl]boronic acid;hydrochloride
InChI Key PWSGJXZLSYWEAJ-UHFFFAOYSA-N
Molecular Formula C8H9BClN5O3
13

3-(Methoxycarbamoyl)benzeneboronic acid, 97%, Thermo Scientific™

CAS: 850567-26-9 Molecular Formula: C8H10BNO4 Molecular Weight (g/mol): 194.98 MDL Number: MFCD04115698 InChI Key: NDJZQOMZZXSXEM-UHFFFAOYSA-N Synonym: 3-methoxycarbamoyl phenyl boronic acid,3-methoxycarbamoyl phenylboronic acid,acmc-209q0e,3-borono-n-methoxybenzamide,boronic acid,b-3-methoxyamino carbonyl phenyl,3-o-methylhydroxylaminocarbonyl benzeneboronic acid,3-o-methylhydroxylaminocarbonyl phenyl boronic acid PubChem CID: 44118753 IUPAC Name: [3-(methoxycarbamoyl)phenyl]boronic acid SMILES: CONC(=O)C1=CC=CC(=C1)B(O)O

PubChem CID 44118753
CAS 850567-26-9
Molecular Weight (g/mol) 194.98
MDL Number MFCD04115698
SMILES CONC(=O)C1=CC=CC(=C1)B(O)O
Synonym 3-methoxycarbamoyl phenyl boronic acid,3-methoxycarbamoyl phenylboronic acid,acmc-209q0e,3-borono-n-methoxybenzamide,boronic acid,b-3-methoxyamino carbonyl phenyl,3-o-methylhydroxylaminocarbonyl benzeneboronic acid,3-o-methylhydroxylaminocarbonyl phenyl boronic acid
IUPAC Name [3-(methoxycarbamoyl)phenyl]boronic acid
InChI Key NDJZQOMZZXSXEM-UHFFFAOYSA-N
Molecular Formula C8H10BNO4
14

1-Naphthaleneboronic acid neopentyl glycol ester, 98%, Thermo Scientific™

CAS: 22871-77-8 Molecular Formula: C15H17BO2 Molecular Weight (g/mol): 240.109 MDL Number: MFCD01318167 InChI Key: VWRKQVBSFBSIOI-UHFFFAOYSA-N Synonym: 1-naphthaleneboronic acid neopentyl glycol ester,5,5-dimethyl-2-naphthalen-1-yl-1,3,2-dioxaborinane,1-naphthaleneboronic acid neopentyl glycol cyclic ester,2-1-naphthyl-5,5-dimethyl-1,3,2-dioxaborinane,5,5-dimethyl-2-alpha-naphthyl-1,3,2-dioxaborinane PubChem CID: 22945154 IUPAC Name: 5,5-dimethyl-2-naphthalen-1-yl-1,3,2-dioxaborinane SMILES: B1(OCC(CO1)(C)C)C2=CC=CC3=CC=CC=C23

PubChem CID 22945154
CAS 22871-77-8
Molecular Weight (g/mol) 240.109
MDL Number MFCD01318167
SMILES B1(OCC(CO1)(C)C)C2=CC=CC3=CC=CC=C23
Synonym 1-naphthaleneboronic acid neopentyl glycol ester,5,5-dimethyl-2-naphthalen-1-yl-1,3,2-dioxaborinane,1-naphthaleneboronic acid neopentyl glycol cyclic ester,2-1-naphthyl-5,5-dimethyl-1,3,2-dioxaborinane,5,5-dimethyl-2-alpha-naphthyl-1,3,2-dioxaborinane
IUPAC Name 5,5-dimethyl-2-naphthalen-1-yl-1,3,2-dioxaborinane
InChI Key VWRKQVBSFBSIOI-UHFFFAOYSA-N
Molecular Formula C15H17BO2