AG002APA

19725-18-9 | Piperidine, 3-(3-methoxyphenyl)-, hydrochloride (1:1)

AG002APA

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CAS Number	19725-18-9
Catalog Number	AG002APA(AGN-PC-02Q7Y5)
Chemical Name	Piperidine, 3-(3-methoxyphenyl)-, hydrochloride (1:1)
IUPAC Name	3-(3-methoxyphenyl)piperidine;hydrochloride
InChI	InChI=1S/C12H17NO.ClH/c1-14-12-6-2-4-10(8-12)11-5-3-7-13-9-11;/h2,4,6,8,11,13H,3,5,7,9H2,1H3;1H
InChI Key	KTJLKTQSWVXPPM-UHFFFAOYSA-N
MDL Number	MFCD05864427
Molecular Formula	C12H18ClNO
Molecular Weight	227.7304
SMILES	COC1=CC(C2CNCCC2)=CC=C1.[H]Cl
Synonyms	3-(3-Methoxyphenyl)piperidine hydrochloride, 19725-18-9, 3-(3-Methoxyphenyl)piperidine HCl, SCHEMBL567518, CTK0E0789, DTXSID00601692, KTJLKTQSWVXPPM-UHFFFAOYSA-N, 6642AD, MFCD05864427, AKOS015846158, ACM19725189, AX8188559, DB-012104, TR-045875, FT-0744785, (+)-3-(3-Methoxyphenyl)piperidine hydrochloride, Piperidine, 3-(3-methoxyphenyl)-, hydrochloride, 3-(3-Methoxyphenyl)piperidine--hydrogen chloride (1/1), Piperidine, 3-(3-methoxyphenyl)-, hydrochloride (1:1), C12H18ClNO,

Complexity	172
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	227.108g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	227.732g/mol
Monoisotopic Mass	227.108g/mol
Rotatable Bond Count	2
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

Lot Number