AG00BYGY

380430-65-9 | 3-Aminomethylphenylboronic acid, pinacol ester, HCl

AG00BYGY

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CAS Number	380430-65-9
Catalog Number	AG00BYGY(AGN-PC-0RFAI1)
Chemical Name	3-Aminomethylphenylboronic acid, pinacol ester, HCl
IUPAC Name	[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanamine;hydrochloride
InChI	InChI=1S/C13H20BNO2.ClH/c1-12(2)13(3,4)17-14(16-12)11-7-5-6-10(8-11)9-15;/h5-8H,9,15H2,1-4H3;1H
InChI Key	BZZYJHQGJDCCCZ-UHFFFAOYSA-N
MDL Number	MFCD03410294
Molecular Formula	C13H21BClNO2
Molecular Weight	269.5753
SMILES	Cl.CC1(C)OB(OC1(C)C)C1=CC=CC(CN)=C1
Synonyms	380430-65-9, (3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)methanamine hydrochloride, 3-AMINOMETHYLPHENYLBORONIC ACID, PINACOL ESTER, HCL, 3-Aminomethylphenylboronic acid pinacol ester HCl, 3-Aminomethylphenylboronic acid pinacol ester hydrochloride, (3-Aminomethylphenyl)boronic acid, pinacol ester hydrochloride, 3-(Aminomethyl)phenylboronic acid pinacol ester hydrochloride, [3-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanamine hydrochloride, [3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanamine hydrochloride, 3-aminomethylphenylboronic acid, pinacol ester hydrochloride, AldrichCPR, AMTB535, SCHEMBL1631610, CTK8B3770, DTXSID30586009, ZXBA000703, ZX-AT000869, ANW-43138, MFCD03410294, AKOS015949486, A1280G1, AS-2568, OR10331, RP07688, RTR-015398, VB10609, KS-000022E6, ACM380430659, L368, SY024389, AX8014967, TR-015398, FT-0644548, MFCD03410294 (95%), A-3746, A823987, 3-(Aminomethyl)phenylboronic acid pinacol ester HCl, J-510789, 3-(Aminomethyl)phenylboronic acid pinacol ester, HCl, 3-Aminomethylbenzeneboronic acid pinacol ester hydrochloride, 3-aminomethylphenylboronic acid, pinacol ester hydrochloride, 97%, 3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzylamine hydrochloride, Benzenemethanamine,3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, hydrochloride (1:1), 1-[3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanamine--hydrogen chloride (1/1), C13H21BClNO2, 3-AMINOMETHYLPHENYLBORONICACID,PINACOLESTER,HCL, 3-(aminomethyl)phenylboronic acid, pinacol ester hydrochloride, (3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PHENYL)METHANAMINE, 2-Methoxy-3-methyl-5-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-pyridine,

Complexity	265
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	269.135g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	269.576g/mol
Monoisotopic Mass	269.135g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	44.5A^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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