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2-Amino-5,5-diphenyl-1,3-oxazol-4-one

HCID 227608
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Basic information

CAS
17925-19-8
Standard SMILES
NC1=NC(=O)C(c2ccccc2)(c2ccccc2)O1
InChIKey
HJLORPOJAABKIP-UHFFFAOYSA-N
Molecular formula
C15H12N2O2
Average molar mass
252.27 g/mol
Monoisotopic mass
252.08987763

Names & identifiers

Preferred name
2-Amino-5,5-diphenyl-1,3-oxazol-4-one
IUPAC
2-amino-5,5-diphenyl-1,3-oxazol-4-one
English name
2-amino-5,5-diphenyl-1,3-oxazol-4-one
Molecular formula
C15H12N2O2
Molecular weight
252.27

Names & synonyms

2-amino-5,5-diphenyl-1,3-oxazol-4-one17925-19-82-amino-5,5-diphenyl-1,3-oxazol-4(5h)-oneNSC19470DTXSID50280971NSC-194704(5H)-Oxazolone, 2-amino-5,5-diphenyl-

Database identifiers

CAS
17925-19-8
PubChem CID
227608
DTXSID
DTXSID50280971

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
64.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
19
Formal charge
0
Complexity
362

Physicochemical properties

Melting point
250 °C · 250 °C (decomp)
Boiling point
400.6 · 400.6±55.0 °C(Predicted)
Density
1.26 · 1.26±0.1 g/cm3(Predicted)
pka
-0.25 · -0.25±0.40(Predicted)

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