3-((1S,2S)-1-Methyl-1-oxido-2-pyrrolidinyl)pyridine

Catalog Number	ACM51095864-1
CAS Number	51095-86-4
Synonyms	Trans-nicotine N'-oxide
Molecular Weight	178.23
InChI	InChI=1S/C10H14N2O/c1-12(13)7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-,12-/m0/s1
InChI Key	RWFBQHICRCUQJJ-JQWIXIFHSA-N
Melting Point	182-183 °C
Purity	90%+
Complexity	186
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Exact Mass	178.110613074
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isomeric SMILES	C[N@@+]1(CCC[C@H]1C2=CN=CC=C2)[O-]
Monoisotopic Mass	178.110613074
PhysicalState	Oil
Rotatable Bond Count	1
Topological Polar Surface Area	31 Ų

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