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866131-81-9 | 3-methanesulfonyl-1,3-thiazolidine-2,4-dione
CAS No: 866131-81-9 Catalog No: AG00IVOH MDL No:MFCD03305743
Product Description
Catalog Number:
AG00IVOH
Chemical Name:
3-methanesulfonyl-1,3-thiazolidine-2,4-dione
CAS Number:
866131-81-9
Molecular Formula:
C4H5NO4S2
Molecular Weight:
195.2168
MDL Number:
MFCD03305743
IUPAC Name:
3-methylsulfonyl-1,3-thiazolidine-2,4-dione
InChI:
InChI=1S/C4H5NO4S2/c1-11(8,9)5-3(6)2-10-4(5)7/h2H2,1H3
InChI Key:
QRCKZZQZROCZTB-UHFFFAOYSA-N
SMILES:
O=C1SCC(=O)N1S(=O)(=O)C
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.966g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
195.207g/mol
Monoisotopic Mass:
194.966g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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