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33664-90-3 | 2(5H)-Oxazolone, 5,5-dimethyl-4-phenyl-
CAS No: 33664-90-3 Catalog No: AG007CST MDL No:
Product Description
Catalog Number:
AG007CST
Chemical Name:
2(5H)-Oxazolone, 5,5-dimethyl-4-phenyl-
CAS Number:
33664-90-3
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
IUPAC Name:
5,5-dimethyl-4-phenyl-1,3-oxazol-2-one
InChI:
InChI=1S/C11H11NO2/c1-11(2)9(12-10(13)14-11)8-6-4-3-5-7-8/h3-7H,1-2H3
InChI Key:
NSIDZVDEAGIFAD-UHFFFAOYSA-N
SMILES:
O=C1N=C(C(O1)(C)C)c1ccccc1
Properties
Complexity:
275
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:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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