AG003MZS

883231-20-7 | 2-BOC-AMINO PYRIDINE-5-BORONIC ACID

AG003MZS

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CAS Number	883231-20-7
Catalog Number	AG003MZS(AGN-PC-0ABVWU)
Chemical Name	2-BOC-AMINO PYRIDINE-5-BORONIC ACID
IUPAC Name	[6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]boronic acid
InChI	InChI=1S/C10H15BN2O4/c1-10(2,3)17-9(14)13-8-5-4-7(6-12-8)11(15)16/h4-6,15-16H,1-3H3,(H,12,13,14)
InChI Key	KAFAFKANQAGBRH-UHFFFAOYSA-N
MDL Number	MFCD11975411
Molecular Formula	C10H15BN2O4
Molecular Weight	238.0481
SMILES	CC(C)(C)OC(=O)NC1=CC=C(C=N1)B(O)O
Synonyms	883231-20-7, (6-((tert-Butoxycarbonyl)amino)pyridin-3-yl)boronic acid, 6-(TERT-BUTOXYCARBONYLAMINO)PYRIDIN-3-YLBORONIC ACID, 2-BOC-AMINO PYRIDINE-5-BORONIC ACID, 6-(BOC-AMINO)PYRIDINE-3-BORONIC ACID, (6-{[(tert-butoxy)carbonyl]amino}pyridin-3-yl)boronic acid, AK-89753, [6-[(2-methylpropan-2-yl)oxycarbonylamino]pyridin-3-yl]boronic acid, {6-[(tert-butoxycarbonyl)amino]pyridin-3-yl}boronic acid, 2-Boc-Aminopyridine-5-boronic acid, 2-(N-Boc-amino)pyridine-5-boronic acid, SCHEMBL2893863, CTK8B9795, DTXSID90716461, KAFAFKANQAGBRH-UHFFFAOYSA-N, Boc-6-Aminopyridine-3-boronic acid, 4098AC, ANW-63104, MFCD11975411, AKOS015892958, ZINC169747239, CS-W006305, FCH1619561, LS21170, PB22578, QC-4877, RL05505, TRA0054546, KS-000006S5, 6-(N-Boc-amino)pyridine-3-boronic acid, DS-16625, OR360493, SC-66334, SY026830, AB0049670, AX8164823, DB-077245, ST2402474, TC-151849, 4CH-005723, FT-0742026, 6-(BOC-AMINO)-3-PYRIDINEBORONIC ACID, MFCD11975411 (95%), D-5192, I04-1689, J-518110, [6-(tert-butoxycarbonylamino)-3-pyridyl]boronic acid, (6-((tert-Butoxycarbonyl);amino);pyridin-3-yl);boronic acid, [6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-pyridinyl]boronic acid, C10H15BN2O4, CB-954, ACN-031654, (6-((tert-Butoxycarbonyl)amino)pyridin-3-yl)boronicacid,

Complexity	268
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	238.112g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	238.05g/mol
Monoisotopic Mass	238.112g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	91.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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