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16240-02-1 | 2,4-Thiazolidinedione, 3-(2-methylphenyl)-
CAS No: 16240-02-1 Catalog No: AG001T2N MDL No:
Product Description
Catalog Number:
AG001T2N
Chemical Name:
2,4-Thiazolidinedione, 3-(2-methylphenyl)-
CAS Number:
16240-02-1
Molecular Formula:
C10H9NO2S
Molecular Weight:
207.2490
IUPAC Name:
3-(2-methylphenyl)-1,3-thiazolidine-2,4-dione
InChI:
InChI=1S/C10H9NO2S/c1-7-4-2-3-5-8(7)11-9(12)6-14-10(11)13/h2-5H,6H2,1H3
InChI Key:
PEXPJQYCDNCTCC-UHFFFAOYSA-N
SMILES:
O=C1SCC(=O)N1c1ccccc1C
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.035g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
207.247g/mol
Monoisotopic Mass:
207.035g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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