AG00270T

179480-58-1 | Piperidine, 3-[(3-methoxyphenyl)methyl]-, hydrochloride (1:1)

AG00270T

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CAS Number	179480-58-1
Catalog Number	AG00270T(AGN-PC-01A9C6)
Chemical Name	Piperidine, 3-[(3-methoxyphenyl)methyl]-, hydrochloride (1:1)
IUPAC Name	3-[(3-methoxyphenyl)methyl]piperidine;hydrochloride
InChI	InChI=1S/C13H19NO.ClH/c1-15-13-6-2-4-11(9-13)8-12-5-3-7-14-10-12;/h2,4,6,9,12,14H,3,5,7-8,10H2,1H3;1H
InChI Key	YYQAQRNCIJUOLX-UHFFFAOYSA-N
MDL Number	MFCD09787524
Molecular Formula	C13H20ClNO
Molecular Weight	241.7570
SMILES	Cl.COC1=CC(CC2CCCNC2)=CC=C1
Synonyms	179480-58-1, 3-(3-Methoxybenzyl)piperidine Hydrochloride, 3-(3-Methoxy-benzyl)-piperidine hydrochloride, 3-(3-METHOXYBENZYL)PIPERIDINE HCL, AR-527/43467599, SCHEMBL8636335, KS-00000DOC, DTXSID60588798, 5638AJ, MFCD09787524, AKOS024438602, AB51587, TRA0033391, ACM179480581, AS-31637, OR307727, SY020950, 3-(3-Methoxybenzyl)piperidineHydrochloride, 3-[(3-Methoxyphenyl)methyl]piperidine HCl, RT-008363, Z-4598, MFCD09787524 (97+%), 3-[(3-Methoxyphenyl)methyl]piperidine--hydrogen chloride (1/1), Piperidine, 3-[(3-methoxyphenyl)methyl]-, hydrochloride (1:1), C13H19NO.HCl, 766487-11-0,

Complexity	183
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	241.123g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	241.759g/mol
Monoisotopic Mass	241.123g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	21.3A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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