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23509-58-2 | 2-Thiazolidinethione, 5-[2-(acetyloxy)ethyl]-3-cyclohexyl-4-hydroxy-4-methyl-
CAS No: 23509-58-2 Catalog No: AG002NG1 MDL No:
Product Description
Catalog Number:
AG002NG1
Chemical Name:
2-Thiazolidinethione, 5-[2-(acetyloxy)ethyl]-3-cyclohexyl-4-hydroxy-4-methyl-
CAS Number:
23509-58-2
Molecular Formula:
C14H23NO3S2
Molecular Weight:
317.4673
IUPAC Name:
2-(3-cyclohexyl-4-hydroxy-4-methyl-2-sulfanylidene-1,3-thiazolidin-5-yl)ethyl acetate
InChI:
InChI=1S/C14H23NO3S2/c1-10(16)18-9-8-12-14(2,17)15(13(19)20-12)11-6-4-3-5-7-11/h11-12,17H,3-9H2,1-2H3
InChI Key:
FCKYDENAUOZGHB-UHFFFAOYSA-N
SMILES:
CC(=O)OCCC1SC(=S)N(C1(C)O)C1CCCCC1
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.112g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
317.462g/mol
Monoisotopic Mass:
317.112g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
107A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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