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1060816-42-3 | (2-methoxypyridin-4-yl)methanesulfonyl chloride
CAS No: 1060816-42-3 Catalog No: AG01DK8J MDL No:MFCD13189397
Product Description
Catalog Number:
AG01DK8J
Chemical Name:
(2-methoxypyridin-4-yl)methanesulfonyl chloride
CAS Number:
1060816-42-3
Molecular Formula:
C7H8ClNO3S
Molecular Weight:
221.6613
MDL Number:
MFCD13189397
IUPAC Name:
(2-methoxypyridin-4-yl)methanesulfonyl chloride
InChI:
InChI=1S/C7H8ClNO3S/c1-12-7-4-6(2-3-9-7)5-13(8,10)11/h2-4H,5H2,1H3
InChI Key:
KEHHNTNPYJYWHF-UHFFFAOYSA-N
SMILES:
COc1nccc(c1)CS(=O)(=O)Cl
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:
1.1
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