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106986-37-2 | 5(4H)-Thiazolethione
CAS No: 106986-37-2 Catalog No: AG009Q82 MDL No:MFCD18822173
Product Description
Catalog Number:
AG009Q82
Chemical Name:
5(4H)-Thiazolethione
CAS Number:
106986-37-2
Molecular Formula:
C3H3NS2
Molecular Weight:
117.1926
MDL Number:
MFCD18822173
IUPAC Name:
4H-1,3-thiazole-5-thione
InChI:
InChI=1S/C3H3NS2/c5-3-1-4-2-6-3/h2H,1H2
InChI Key:
HCIWYOYBZDMBNJ-UHFFFAOYSA-N
SMILES:
C1N=CSC1=S
Properties
Complexity:
97
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
116.971g/mol
Formal Charge:
0
Heavy Atom Count:
6
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
117.184g/mol
Monoisotopic Mass:
116.971g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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