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100400-44-0 | 3-(2-Ethylhexyl)-2-thioxo-1,3-thiazolidin-4-one
CAS No: 100400-44-0 Catalog No: AG01EB03 MDL No:
Product Description
Catalog Number:
AG01EB03
Chemical Name:
3-(2-Ethylhexyl)-2-thioxo-1,3-thiazolidin-4-one
CAS Number:
100400-44-0
IUPAC Name:
3-(2-ethylhexyl)-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C11H19NOS2/c1-3-5-6-9(4-2)7-12-10(13)8-15-11(12)14/h9H,3-8H2,1-2H3
InChI Key:
OZBSCMAKAAMRRB-UHFFFAOYSA-N
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.091g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.399g/mol
Monoisotopic Mass:
245.091g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
77.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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