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89295-42-1 | 2,4-Thiazolidinedione, 3-ethyl-5,5-dimethyl-
CAS No: 89295-42-1 Catalog No: AG0040DG MDL No:
Product Description
Catalog Number:
AG0040DG
Chemical Name:
2,4-Thiazolidinedione, 3-ethyl-5,5-dimethyl-
CAS Number:
89295-42-1
Molecular Formula:
C7H11NO2S
Molecular Weight:
173.2327
IUPAC Name:
3-ethyl-5,5-dimethyl-1,3-thiazolidine-2,4-dione
InChI:
InChI=1S/C7H11NO2S/c1-4-8-5(9)7(2,3)11-6(8)10/h4H2,1-3H3
InChI Key:
WGOLCRKLYSLSFT-UHFFFAOYSA-N
SMILES:
CCN1C(=O)SC(C1=O)(C)C
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.051g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.23g/mol
Monoisotopic Mass:
173.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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