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Home > Pyridines > 1864057-77-1
1864057-77-1 | 2-((AZETIDIN-3-YLMETHYL)THIO)PYRIDINE HYDROCHLORIDE
CAS No: 1864057-77-1 Catalog No: AG01ASI3 MDL No:MFCD28125863
Product Description
Catalog Number:
AG01ASI3
Chemical Name:
2-((AZETIDIN-3-YLMETHYL)THIO)PYRIDINE HYDROCHLORIDE
CAS Number:
1864057-77-1
Molecular Formula:
C9H13ClN2S
Molecular Weight:
216.7309
MDL Number:
MFCD28125863
IUPAC Name:
2-(azetidin-3-ylmethylsulfanyl)pyridine;hydrochloride
InChI:
InChI=1S/C9H12N2S.ClH/c1-2-4-11-9(3-1)12-7-8-5-10-6-8;/h1-4,8,10H,5-7H2;1H
InChI Key:
UCZOBBAMXXLDOU-UHFFFAOYSA-N
SMILES:
N1CC(C1)CSc1ccccn1.Cl
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.049g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.727g/mol
Monoisotopic Mass:
216.049g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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