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89295-48-7 | 2,4-Thiazolidinedione, 5,5-dimethyl-3-pentyl-
CAS No: 89295-48-7 Catalog No: AG003ZVU MDL No:
Product Description
Catalog Number:
AG003ZVU
Chemical Name:
2,4-Thiazolidinedione, 5,5-dimethyl-3-pentyl-
CAS Number:
89295-48-7
Molecular Formula:
C10H17NO2S
Molecular Weight:
215.3125
IUPAC Name:
5,5-dimethyl-3-pentyl-1,3-thiazolidine-2,4-dione
InChI:
InChI=1S/C10H17NO2S/c1-4-5-6-7-11-8(12)10(2,3)14-9(11)13/h4-7H2,1-3H3
InChI Key:
YQLVMTLAZIOBDV-UHFFFAOYSA-N
SMILES:
CCCCCN1C(=O)SC(C1=O)(C)C
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.098g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.311g/mol
Monoisotopic Mass:
215.098g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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