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10048-54-1 | 2H-1,3-Thiazine-2,4(3H)-dione, 5-methyl-
CAS No: 10048-54-1 Catalog No: AG000237 MDL No:
Product Description
Catalog Number:
AG000237
Chemical Name:
2H-1,3-Thiazine-2,4(3H)-dione, 5-methyl-
CAS Number:
10048-54-1
Molecular Formula:
C5H5NO2S
Molecular Weight:
143.1637
IUPAC Name:
5-methyl-1,3-thiazine-2,4-dione
InChI:
InChI=1S/C5H5NO2S/c1-3-2-9-5(8)6-4(3)7/h2H,1H3,(H,6,7,8)
InChI Key:
RHWUNRXGCOWRKD-UHFFFAOYSA-N
SMILES:
Cc1csc(=O)[nH]c1=O
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
143.004g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
143.16g/mol
Monoisotopic Mass:
143.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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