AG003N4G

1072945-75-5 | 6-Bromo-4-Methylpyridin-3-Ylboronic Acid

AG003N4G

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CAS Number	1072945-75-5
Catalog Number	AG003N4G(AGN-PC-078JTB)
Chemical Name	6-Bromo-4-Methylpyridin-3-Ylboronic Acid
IUPAC Name	(6-bromo-4-methylpyridin-3-yl)boronic acid
InChI	InChI=1S/C6H7BBrNO2/c1-4-2-6(8)9-3-5(4)7(10)11/h2-3,10-11H,1H3
InChI Key	SVONARQIVBDOGB-UHFFFAOYSA-N
MDL Number	MFCD09037489
Molecular Formula	C6H7BBrNO2
Molecular Weight	215.8403
SMILES	CC1=CC(Br)=NC=C1B(O)O
Synonyms	1072945-75-5, (6-Bromo-4-methylpyridin-3-yl)boronic acid, 6-Bromo-4-methylpyridine-3-boronic acid, 2-Bromo-4-methylpyridine-5-boronic acid, 6-BROMO-4-METHYLPYRIDIN-3-YLBORONIC ACID, CTK4A5202, KS-00000YTD, BORONIC ACID, B-(6-BROMO-4-METHYL-3-PYRIDINYL)-, DTXSID30660631, ANW-15593, MFCD09037489, AKOS015835436, ZINC169744875, FCH1325869, RTR-001525, AS-55783, BC001916, (6-bromo-4-methyl-3-pyridyl)boronic acid, AX8244777, DB-010354, TR-001525, (6-bromo-4-methyl-3-pyridinyl)boronic acid, FT-0715054, ST24034915, Y3617, Q-7379, (6-bromanyl-4-methyl-pyridin-3-yl)boronic acid, 2-BROMO-4-METHYLPYRIDIN-5-YLBORONIC ACID, I14-57472, B-(6-BROMO-4-METHYL-3-PYRIDINYL)-BORONIC ACID, C6H7BBrNO2,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.975g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	215.841g/mol
Monoisotopic Mass	214.975g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	53.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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