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864758-02-1 | (5-Chloropyridin-2-yl)methyl methanesulfonate
CAS No: 864758-02-1 Catalog No: AG004QPG MDL No:MFCD23135451
Product Description
Catalog Number:
AG004QPG
Chemical Name:
(5-Chloropyridin-2-yl)methyl methanesulfonate
CAS Number:
864758-02-1
Molecular Formula:
C7H8ClNO3S
Molecular Weight:
221.6613
MDL Number:
MFCD23135451
IUPAC Name:
(5-chloropyridin-2-yl)methyl methanesulfonate
InChI:
InChI=1S/C7H8ClNO3S/c1-13(10,11)12-5-7-3-2-6(8)4-9-7/h2-4H,5H2,1H3
InChI Key:
WTCGXRIUCCNDOL-UHFFFAOYSA-N
SMILES:
Clc1ccc(nc1)COS(=O)(=O)C
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.991g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.655g/mol
Monoisotopic Mass:
220.991g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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