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88091-05-8 | 4H-1,3-Oxazin-4-one, 2,3-dihydro-6-methyl-3-phenyl-
CAS No: 88091-05-8 Catalog No: AG004EK5 MDL No:
Product Description
Catalog Number:
AG004EK5
Chemical Name:
4H-1,3-Oxazin-4-one, 2,3-dihydro-6-methyl-3-phenyl-
CAS Number:
88091-05-8
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
IUPAC Name:
6-methyl-3-phenyl-2H-1,3-oxazin-4-one
InChI:
InChI=1S/C11H11NO2/c1-9-7-11(13)12(8-14-9)10-5-3-2-4-6-10/h2-7H,8H2,1H3
InChI Key:
GOLXVKPCHPJVIL-UHFFFAOYSA-N
SMILES:
O=C1C=C(C)OCN1c1ccccc1
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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