AG01D94I

31945-06-9 | (S)-3-(Piperidin-2-Yl)Pyridine Dihydrochloride

AG01D94I

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CAS Number	31945-06-9
Catalog Number	AG01D94I(AGN-PC-0WNGO1)
Chemical Name	(S)-3-(Piperidin-2-Yl)Pyridine Dihydrochloride
IUPAC Name	3-[(2S)-piperidin-2-yl]pyridine;dihydrochloride
InChI	InChI=1S/C10H14N2.2ClH/c1-2-7-12-10(5-1)9-4-3-6-11-8-9;;/h3-4,6,8,10,12H,1-2,5,7H2;2*1H/t10-;;/m0../s1
InChI Key	YVAXNODSVITPGV-XRIOVQLTSA-N
MDL Number	MFCD07375397
Molecular Formula	C10H16Cl2N2
Molecular Weight	235.1534
SMILES	[H]Cl.[H]Cl.C1([C@H]2NCCCC2)=CC=CN=C1
UNII	I47666V43D
Synonyms	Anabasine dihydrochloride, 31945-06-9, UNII-I47666V43D, I47666V43D, (S)-3-(Piperidin-2-yl)pyridine dihydrochloride, Anabasine, dihydrochloride, Pyridine, 3-(2-piperidinyl)-, dihydrochloride, (S)-, Pyridine, 3-(2S)-2-piperidinyl-, hydrochloride (1:2), DTXSID20185782, MFCD07375397, AKOS005227452, (S)-3-(Piperidin-2-yl)pyridine 2HCl,

Complexity	136
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	234.069g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	235.152g/mol
Monoisotopic Mass	234.069g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	24.9A^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
UN Code

Certificate of Analysis

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