AG00I7PK

389621-83-4 | Boronic acid, [4-(1-piperidinylcarbonyl)phenyl]-

AG00I7PK

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CAS Number	389621-83-4
Catalog Number	AG00I7PK(AGN-PC-0KKVJ2)
Chemical Name	Boronic acid, [4-(1-piperidinylcarbonyl)phenyl]-
IUPAC Name	[4-(piperidine-1-carbonyl)phenyl]boronic acid
InChI	InChI=1S/C12H16BNO3/c15-12(14-8-2-1-3-9-14)10-4-6-11(7-5-10)13(16)17/h4-7,16-17H,1-3,8-9H2
InChI Key	PUXUKRSBJVVKMD-UHFFFAOYSA-N
MDL Number	MFCD03411951
Molecular Formula	C12H16BNO3
Molecular Weight	233.0713
SMILES	OB(O)C1=CC=C(C=C1)C(=O)N1CCCCC1
Synonyms	4-(Piperidine-1-carbonyl)phenylboronic acid, 389621-83-4, [4-(piperidine-1-carbonyl)phenyl]boronic Acid, 1-(4-Boronobenzoyl)piperidine, (4-Boronophenyl)(piperidin-1-yl)methanone, 4-(1-PIPERIDINYLCARBONYL)PHENYLBORONIC ACID, BORONIC ACID, [4-(1-PIPERIDINYLCARBONYL)PHENYL]-, ACMC-1CSWG, 4-(Piperidine-1-carbonyl)benzeneboronic acid, AC1MCN51, AMTB269, SCHEMBL258027, CTK4I0754, DTXSID40378558, PUXUKRSBJVVKMD-UHFFFAOYSA-N, ANW-28994, CP-335, MFCD03411951, AKOS015854084, ZINC169745316, AB14318, P5053G1, PS-9604, RTR-015665, BC001017, N200, 4-(Piperidine-1-carbonyl)phenylboronicacid, DB-010637, TR-015665, (4-piperidin-1-ylcarbonylphenyl)boronic acid, FT-0647393, ST24043135, 4-(Piperidin-1-ylcarbonyl)benzeneboronic acid, B-3322, 4-[(Piperidin-1-yl)carbonyl]benzeneboronic acid, [4-[oxo(1-piperidinyl)methyl]phenyl]boronic acid, A824352, Boronicacid,B-[4-(1-piperidinylcarbonyl)phenyl]-, 4 - (Piperidine - 1 - carbonyl)phenylboronic acid, 4-(1-PIPERIDINYLCARBONYL)BENZENEBORONIC ACID, 4-(1-Piperidinylcarbonyl)benzeneboronic acid, 97%, Boronic acid,B-[4-(1-piperidinylcarbonyl)phenyl]-, C12H16BNO3, ACN-042832, CID2773567, Boronic acid, [4-(1-piperidinylcarbonyl)phenyl]- (9CI),

Complexity	259
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	233.122g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	233.074g/mol
Monoisotopic Mass	233.122g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	60.8A^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	P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
UN Code

Certificate of Analysis

Lot Number