1-Phenylimidazolidin-2-one

HCID 255273

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Basic information

CAS: 1848-69-7
Standard SMILES: O=C1NCCN1c1ccccc1
InChIKey: QKKGTRSHKSWYAK-UHFFFAOYSA-N
Molecular formula: C9H10N2O
Average molar mass: 162.19 g/mol
Monoisotopic mass: 162.07931294

Names & identifiers

Preferred name: 1-Phenylimidazolidin-2-one
IUPAC: 1-phenylimidazolidin-2-one
English name: 1-Phenyl-imidazolidin-2-one
Molecular formula: C9H10N2O
Molecular weight: 162.19

Names & synonyms

1-Phenylimidazolidin-2-one1848-69-7DTXSID90292174RefChem:435717DTXCID20243316664-112-71-Phenyl-2-imidazolidinone1-phenyl-imidazolidin-2-one2-Imidazolidinone,1-phenyl-2-Imidazolidinone, 1-phenyl-MFCD026710663-Phenyl-2-imidazolidinone

Show more names

1-Phenylimidazol-2-one2-Oxo-1-phenylimidazolidine, (2-Oxoimidazolidin-1-yl)benzene

MLS002694410NSC-80633NSC80633N-phenylimidazolidoneN-phenyl-imidazolidinonephenyl imidazolin-2-one1-phenylimidazolidine-2-oneH5LC49EB2N

Database identifiers

CAS: 1848-69-7
PubChem CID: 255273
DTXSID: DTXSID90292174
ChEMBL: CHEMBL1893121
UNII: H5LC49EB2N
EC Number: 664-112-7
Nikkaji: J101.441B

Properties

Computed structural properties

XLogP: 0.9
Topological polar surface area: 32.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 12
Formal charge: 0
Complexity: 175

Physicochemical properties

Melting point: 68 °C · 68 °C
Density: 1.188 · 1.188±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C
pka: 14 · 14+-.0.20(Predicted)
Appearance: White to light yellow Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H320-H335
Precautionary statements: 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
Hazard Codes: Xi
Safety Statements: 24 · 24/25
HS Code: 29349990 · 29349990