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805324-03-2 | 4-Thiazolidinone, 3-(1-oxohexadecyl)-2-thioxo-
CAS No: 805324-03-2 Catalog No: AG0052GU MDL No:
Product Description
Catalog Number:
AG0052GU
Chemical Name:
4-Thiazolidinone, 3-(1-oxohexadecyl)-2-thioxo-
CAS Number:
805324-03-2
Molecular Formula:
C19H33NO2S2
Molecular Weight:
371.6008
IUPAC Name:
3-hexadecanoyl-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C19H33NO2S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(21)20-18(22)16-24-19(20)23/h2-16H2,1H3
InChI Key:
RNIATLQGCMDNRE-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCC(=O)N1C(=S)SCC1=O
Properties
Complexity:
399
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
371.195g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
371.598g/mol
Monoisotopic Mass:
371.195g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
94.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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