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101258-21-3 | 3-methyl-1lambda6,2-thiazolidine-1,1-dione
CAS No: 101258-21-3 Catalog No: AG01BION MDL No:MFCD27940849
Product Description
Catalog Number:
AG01BION
Chemical Name:
3-methyl-1lambda6,2-thiazolidine-1,1-dione
CAS Number:
101258-21-3
Molecular Formula:
C4H9NO2S
Molecular Weight:
135.1848
MDL Number:
MFCD27940849
IUPAC Name:
3-methyl-1,2-thiazolidine 1,1-dioxide
InChI:
InChI=1S/C4H9NO2S/c1-4-2-3-8(6,7)5-4/h4-5H,2-3H2,1H3
InChI Key:
ULZOVNGHPDAGMF-UHFFFAOYSA-N
SMILES:
CC1CCS(=O)(=O)N1
Properties
Complexity:
167
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.035g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
135.181g/mol
Monoisotopic Mass:
135.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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