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5053-24-7 | 2-(Methylthio)thiazole
CAS No: 5053-24-7 Catalog No: AG003B2M MDL No:MFCD00858981
Product Description
Catalog Number:
AG003B2M
Chemical Name:
2-(Methylthio)thiazole
CAS Number:
5053-24-7
Molecular Formula:
C4H5NS2
Molecular Weight:
131.2192
MDL Number:
MFCD00858981
IUPAC Name:
2-methylsulfanyl-1,3-thiazole
InChI:
InChI=1S/C4H5NS2/c1-6-4-5-2-3-7-4/h2-3H,1H3
InChI Key:
VQNOAXZUEKPSJC-UHFFFAOYSA-N
SMILES:
CSc1nccs1
Properties
Complexity:
57.7
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:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
131.211g/mol
Monoisotopic Mass:
130.986g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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