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5685-06-3 | 4-methylthiazole-2(3H)-thione
CAS No: 5685-06-3 Catalog No: AG00EJXI MDL No:MFCD00798571
Product Description
Catalog Number:
AG00EJXI
Chemical Name:
4-methylthiazole-2(3H)-thione
CAS Number:
5685-06-3
Molecular Formula:
C4H5NS2
Molecular Weight:
131.2192
MDL Number:
MFCD00798571
IUPAC Name:
4-methyl-3H-1,3-thiazole-2-thione
InChI:
InChI=1S/C4H5NS2/c1-3-2-7-4(6)5-3/h2H,1H3,(H,5,6)
InChI Key:
NLHAIPFBNQZTMY-UHFFFAOYSA-N
SMILES:
Cc1csc(n1)S
EC Number:
227-152-2
NSC Number:
40808
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
130.986g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
131.211g/mol
Monoisotopic Mass:
130.986g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
69.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Evaluation of insulin-mimetic activities of vanadyl and zinc(II) complexes from the viewpoint of heterocyclic bidentate ligands. | Journal of inorganic biochemistry 20090401 |
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