AG00EBNS

634905-21-8 | 3-(Piperidino)phenylboronic acid

AG00EBNS

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CAS Number	634905-21-8
Catalog Number	AG00EBNS(AGN-PC-01NIMH)
Chemical Name	3-(Piperidino)phenylboronic acid
IUPAC Name	(3-piperidin-1-ylphenyl)boronic acid
InChI	InChI=1S/C11H16BNO2/c14-12(15)10-5-4-6-11(9-10)13-7-2-1-3-8-13/h4-6,9,14-15H,1-3,7-8H2
InChI Key	JKXVWJCIIFBENM-UHFFFAOYSA-N
MDL Number	MFCD03094966
Molecular Formula	C11H16BNO2
Molecular Weight	205.0612
SMILES	OB(O)C1=CC(=CC=C1)N1CCCCC1
Synonyms	634905-21-8, (3-(Piperidin-1-yl)phenyl)boronic acid, 3-(Piperidino)phenylboronic acid, [3-(1-piperidyl)phenyl]boronic acid, BORONIC ACID, B-[3-(1-PIPERIDINYL)PHENYL]-, 3-(piperidin-1-yl)phenylboronic acid, AK-85465, Boronic acid, [3-(1-piperidinyl)phenyl]-, [3-(Piperidin-1-yl)phenyl]boronic acid, SCHEMBL1529259, CTK5B9383, DTXSID20591925, 3-(piperidino)phenyl boronic acid, JKXVWJCIIFBENM-UHFFFAOYSA-N, ANW-67635, MFCD03094966, AKOS015854110, ZINC169794607, DS-18084, OR361547, SC-64802, AX8238341, TR-037359, CS-0028797, FT-0686450, ST24034284, X0912, 3-(piperidin-1-yl)phenylboronic acid, AldrichCPR, I04-2896, C11H16BNO2,

Complexity	195
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	205.127g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	205.064g/mol
Monoisotopic Mass	205.127g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	43.7A^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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