AG001QLE

159275-17-9 | 1-Piperidinecarboxylic acid, 4-(bromomethyl)-, phenylmethyl ester

AG001QLE

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CAS Number	159275-17-9
Catalog Number	AG001QLE(AGN-PC-0KKXEV)
Chemical Name	1-Piperidinecarboxylic acid, 4-(bromomethyl)-, phenylmethyl ester
IUPAC Name	benzyl 4-(bromomethyl)piperidine-1-carboxylate
InChI	InChI=1S/C14H18BrNO2/c15-10-12-6-8-16(9-7-12)14(17)18-11-13-4-2-1-3-5-13/h1-5,12H,6-11H2
InChI Key	XJHKDSZGAWXUTB-UHFFFAOYSA-N
MDL Number	MFCD02681989
Molecular Formula	C14H18BrNO2
Molecular Weight	312.2022
SMILES	O=C(N1CCC(CBr)CC1)OCC2=CC=CC=C2
Synonyms	159275-17-9, Benzyl 4-(Bromomethyl)Tetrahydro-1(2H)-Pyridinecarboxylate, Benzyl 4-(bromomethyl)piperidine-1-carboxylate, 1-Cbz-4-(Bromomethyl)piperidine, 1-Piperidinecarboxylic acid, 4-(bromomethyl)-, phenylmethyl ester, N-CBZ-4-(BROMOMETHYL)PIPERIDINE, AK-40167, phenylmethyl 4-(bromomethyl)piperidinecarboxylate, W-205153, W-205837, Benzyl 4-(bromomethyl)tetrahydro-1(2h)pyridinecarboxylate, PubChem9199, AC1MCQUH, AC1Q27Q3, SCHEMBL1430074, CTK4D0020, KS-00000DNT, DTXSID40379944, BUTTPARK 95\50-67, XJHKDSZGAWXUTB-UHFFFAOYSA-N, ZINC158641, ZX-AT002956, MFCD02681989, SBB054962, AKOS015901997, AB12168, CS-W002953, FCH2712798, OR23105, RP06902, RTC-071780, TRA0163812, VP14888, AJ-15279, AS-37177, BC003422, CC-24459, CJ-01795, SC-01431, SY002842, ZB006994, 4-(Bromomethyl)piperidine,N-CBZ protected, AB0040120, AX8015499, BENZYLOXYCARBONYLBROMOMETHYLPIPERIDINE, DB-017645, TC-071780, FT-0622802, ST24046110, Y7683, A25912, Benzyl 4-(bromomethyl)-1-piperidinecarboxylate, H11013, K-4990, MFCD02681989 (97+%), C-19301, Benzyl 4-(bromomethyl)tetrahydro-1(2H)-pyridinecar, phenylmethyl 4-(bromomethyl)-1-piperidinecarboxylate, 4-Bromomethylpiperidine-1-carboxylic acid benzyl ester, I14-13184, N-(BENZYLOXYCARBONYL)-4-(BROMOMETHYL)PIPERIDINE, Benzyl 4-(bromomethyl)-1-piperidinecarboxylate, AldrichCPR, Benzyl4-(Bromomethyl)tetrahydro-1(2H)-pyridinecarboxylate, 1-Piperidinecarboxylicacid, 4-(bromomethyl)-, phenylmethyl ester, BENZYL 4-(BROMOETHYL)TETRAHYDRO-1(2H)-PYRIDINECARBOXYLATE, Benzyl 4-(bromoethyl)tetrahydro-1(2H)-pyridinecarboxylate;4-(Bromomethyl)piperidine, N-CBZ protected;N-(Benzyloxycarbonyl)-4-(bromomethyl)piperidine, C14H18BrNO2, ZINC00158641, CID2776274, 4-Bromomethyl-piperidine-1-carboxylic acid benzyl ester, benzyl 4-(hydroxymethyl)tetrahydro-1(2h)-pyridinecarboxylate, 399580-55-3,

Complexity	259
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	311.052g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	312.207g/mol
Monoisotopic Mass	311.052g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

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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