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86148-73-4 | 4H-1,3-Thiazin-4-one, 6-methyl-2-propyl-
CAS No: 86148-73-4 Catalog No: AG004TJT MDL No:
Product Description
Catalog Number:
AG004TJT
Chemical Name:
4H-1,3-Thiazin-4-one, 6-methyl-2-propyl-
CAS Number:
86148-73-4
Molecular Formula:
C8H11NOS
Molecular Weight:
169.2440
IUPAC Name:
6-methyl-2-propyl-1,3-thiazin-4-one
InChI:
InChI=1S/C8H11NOS/c1-3-4-8-9-7(10)5-6(2)11-8/h5H,3-4H2,1-2H3
InChI Key:
ZRMJIUZBGZENFM-UHFFFAOYSA-N
SMILES:
CCCc1nc(=O)cc(s1)C
Properties
Complexity:
230
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.056g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.242g/mol
Monoisotopic Mass:
169.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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