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88152-54-9 | 4H-1,3-Thiazin-4-one, 2,3-dihydro-6-methyl-2-phenyl-
CAS No: 88152-54-9 Catalog No: AG004D2T MDL No:
Product Description
Catalog Number:
AG004D2T
Chemical Name:
4H-1,3-Thiazin-4-one, 2,3-dihydro-6-methyl-2-phenyl-
CAS Number:
88152-54-9
Molecular Formula:
C11H11NOS
Molecular Weight:
205.2761
IUPAC Name:
6-methyl-2-phenyl-2,3-dihydro-1,3-thiazin-4-one
InChI:
InChI=1S/C11H11NOS/c1-8-7-10(13)12-11(14-8)9-5-3-2-4-6-9/h2-7,11H,1H3,(H,12,13)
InChI Key:
YCVXQLFOBWCTDT-UHFFFAOYSA-N
SMILES:
O=C1C=C(C)SC(N1)c1ccccc1
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.056g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
205.275g/mol
Monoisotopic Mass:
205.056g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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