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89570-06-9 | 1,2,4-Dithiazolidin-3-one, 4-(1-methylethyl)-5-thioxo-
CAS No: 89570-06-9 Catalog No: AG0086LO MDL No:
Product Description
Catalog Number:
AG0086LO
Chemical Name:
1,2,4-Dithiazolidin-3-one, 4-(1-methylethyl)-5-thioxo-
CAS Number:
89570-06-9
Molecular Formula:
C5H7NOS3
Molecular Weight:
193.3102
IUPAC Name:
4-propan-2-yl-5-sulfanylidene-1,2,4-dithiazolidin-3-one
InChI:
InChI=1S/C5H7NOS3/c1-3(2)6-4(7)9-10-5(6)8/h3H,1-2H3
InChI Key:
RVHPGPMDGNHRNH-UHFFFAOYSA-N
SMILES:
CC(n1c(=O)ssc1=S)C
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.969g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.297g/mol
Monoisotopic Mass:
192.969g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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