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32497-10-2 | 4-METHYL-1,3-THIAZOL-2(3H)-ONE
CAS No: 32497-10-2 Catalog No: AG00CLGA MDL No:MFCD00970121
Product Description
Catalog Number:
AG00CLGA
Chemical Name:
4-METHYL-1,3-THIAZOL-2(3H)-ONE
CAS Number:
32497-10-2
Molecular Formula:
C4H5NOS
Molecular Weight:
115.1536
MDL Number:
MFCD00970121
IUPAC Name:
4-methyl-3H-1,3-thiazol-2-one
InChI:
InChI=1S/C4H5NOS/c1-3-2-7-4(6)5-3/h2H,1H3,(H,5,6)
InChI Key:
ZMEVDFFLOPFGCR-UHFFFAOYSA-N
SMILES:
Cc1csc(=O)[nH]1
NSC Number:
4484
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
115.009g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
115.15g/mol
Monoisotopic Mass:
115.009g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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