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1000394-87-5 | (2-methyl-1,3-thiazol-4-yl)methanesulfonyl chloride
CAS No: 1000394-87-5 Catalog No: AG01AFBE MDL No:MFCD16671829
Product Description
Catalog Number:
AG01AFBE
Chemical Name:
(2-methyl-1,3-thiazol-4-yl)methanesulfonyl chloride
CAS Number:
1000394-87-5
Molecular Formula:
C5H6ClNO2S2
Molecular Weight:
211.6896
MDL Number:
MFCD16671829
IUPAC Name:
(2-methyl-1,3-thiazol-4-yl)methanesulfonyl chloride
InChI:
InChI=1S/C5H6ClNO2S2/c1-4-7-5(2-10-4)3-11(6,8)9/h2H,3H2,1H3
InChI Key:
IJAYMUFRRBWQPU-UHFFFAOYSA-N
SMILES:
Cc1scc(n1)CS(=O)(=O)Cl
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.953g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.678g/mol
Monoisotopic Mass:
210.953g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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