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Home > Pyridines > 1864073-57-3
1864073-57-3 | 2-([2-(PIPERIDIN-2-YL)ETHYL]SULFANYL)PYRIDINE HYDROCHLORIDE
CAS No: 1864073-57-3 Catalog No: AG01AT6Z MDL No:MFCD26793239
Product Description
Catalog Number:
AG01AT6Z
Chemical Name:
2-([2-(PIPERIDIN-2-YL)ETHYL]SULFANYL)PYRIDINE HYDROCHLORIDE
CAS Number:
1864073-57-3
Molecular Formula:
C12H19ClN2S
Molecular Weight:
258.8107
MDL Number:
MFCD26793239
IUPAC Name:
2-(2-piperidin-2-ylethylsulfanyl)pyridine;hydrochloride
InChI:
InChI=1S/C12H18N2S.ClH/c1-3-8-13-11(5-1)7-10-15-12-6-2-4-9-14-12;/h2,4,6,9,11,13H,1,3,5,7-8,10H2;1H
InChI Key:
PKPMVMINPQCPOL-UHFFFAOYSA-N
SMILES:
C1CCC(NC1)CCSc1ccccn1.Cl
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.096g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
258.808g/mol
Monoisotopic Mass:
258.096g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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