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37791-41-6 | 5(4H)-Oxazolone, 4-ethylidene-2-phenyl-
CAS No: 37791-41-6 Catalog No: AG0077S4 MDL No:
Product Description
Catalog Number:
AG0077S4
Chemical Name:
5(4H)-Oxazolone, 4-ethylidene-2-phenyl-
CAS Number:
37791-41-6
Molecular Formula:
C11H9NO2
Molecular Weight:
187.1947
IUPAC Name:
4-ethylidene-2-phenyl-1,3-oxazol-5-one
InChI:
InChI=1S/C11H9NO2/c1-2-9-11(13)14-10(12-9)8-6-4-3-5-7-8/h2-7H,1H3
InChI Key:
HEGNHTODZSHTKS-UHFFFAOYSA-N
SMILES:
CC=C1N=C(OC1=O)c1ccccc1
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.063g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.198g/mol
Monoisotopic Mass:
187.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.3
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