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82238-48-0 | 2(5H)-Oxazolone, 4,5-diphenyl-5-(2-propenyl)-
CAS No: 82238-48-0 Catalog No: AG00500S MDL No:
Product Description
Catalog Number:
AG00500S
Chemical Name:
2(5H)-Oxazolone, 4,5-diphenyl-5-(2-propenyl)-
CAS Number:
82238-48-0
Molecular Formula:
C18H15NO2
Molecular Weight:
277.3172
IUPAC Name:
4,5-diphenyl-5-prop-2-enyl-1,3-oxazol-2-one
InChI:
InChI=1S/C18H15NO2/c1-2-13-18(15-11-7-4-8-12-15)16(19-17(20)21-18)14-9-5-3-6-10-14/h2-12H,1,13H2
InChI Key:
VFEAVNMZKQOLJD-UHFFFAOYSA-N
SMILES:
C=CCC1(OC(=O)N=C1c1ccccc1)c1ccccc1
Properties
Complexity:
431
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.11g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.323g/mol
Monoisotopic Mass:
277.11g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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