AG00I937

50606-58-1 | 1-Benzylpiperidin-3-one, HCl

AG00I937

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CAS Number	50606-58-1
Catalog Number	AG00I937(AGN-PC-0KP0QI)
Chemical Name	1-Benzylpiperidin-3-one, HCl
EC Number	256-646-0
IUPAC Name	1-benzylpiperidin-3-one;hydrochloride
InChI	InChI=1S/C12H15NO.ClH/c14-12-7-4-8-13(10-12)9-11-5-2-1-3-6-11;/h1-3,5-6H,4,7-10H2;1H
InChI Key	OVWSFXNSJDMRPV-UHFFFAOYSA-N
MDL Number	MFCD00012791
Molecular Formula	C12H16ClNO
Molecular Weight	225.7145
SMILES	O=C1CN(CC2=CC=CC=C2)CCC1.[H]Cl
Synonyms	50606-58-1, 1-Benzyl-3-piperidone Hydrochloride, 1-benzylpiperidin-3-one hydrochloride, 1-Benzyl-3-piperidinone hydrochloride, 3-Piperidinone, 1-(phenylmethyl)-, hydrochloride, 1-Benzylpiperidin-3-one, HCl, 1-BENZYLPIPERIDIN-3-ONE HCL, MFCD00150096, 1-benzyl-3-piperidone hydrate hydrochloride, 1-(phenylmethyl)-3-piperidinone hydrochloride, 1-Benzyl-3-piperidone hydrate hydrochloride, 95%, 1-Benzyl-3-piperidone HCl hydrate, N-Benzyl-3-piperidone hydrochloride, EINECS 256-646-0, PubChem7726, PubChem9397, ACMC-1AWHY, AC1MJ3IQ, AC1Q3EKZ, KSC495I7L, SCHEMBL1243957, CTK3J5475, DTXSID60198654, OVWSFXNSJDMRPV-UHFFFAOYSA-N, 1-benzylpiperidin-3-one, chloride, ACT02068, BCP04561, ANW-31060, MFCD00012791, SC3111, AKOS005259740, 1-benzyl-piperidin-3-one hydrochloride, LS20724, MCULE-9491573942, RL03859, RP27619, RP27620, RTC-062017, SB10201, TRA0090477, VZ21189, KS-0000032Y, AK-35368, AS-12347, BC219306, BR-35368, SC-04894, 1-benzyl-piperidin-3-one hydrochloride salt, AB0011775, TC-062017, 1(phenylmethyl)-3-piperidinone hydrochloride, 4CH-013400, AM20040582, B3419, FT-0080566, ST50319859, Z4809, 1-benzyl-3-piperidinone hydrate hydrochloride, EN300-37473, 14B496, M-1900, 606B581, J-504285, I14-11869, 1-Benzyl-3-piperidinone, C12H16ClNO, C12H15NO.HCl, 1-Benzyl-3-piperidone hydrochloride hydrate, C12-H15-N-O.Cl-H, 1-Benzyl-3-piperidonehydrochloride, 1-Benzyl-3-piperidonehydratehydrochl, ACN-001596, CID3084924, 40114-49-6, 1-Benzyl-3-piperidone hydrochloride, 98% - 1G 1g,

Complexity	197
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	225.092g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	225.716g/mol
Monoisotopic Mass	225.092g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	20.3A^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
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number