Basic information
- CAS
27151-01-5- Standard SMILES
c1ccc(NC2=NCCO2)cc1- InChIKey
CIDMUJMGDBSMQW-UHFFFAOYSA-N- Molecular formula
- C9H10N2O
- Average molar mass
- 162.19 g/mol
- Monoisotopic mass
- 162.07931295
Names & identifiers
- Preferred name
- 2-Phenyliminooxazolidine
- IUPAC
- N-phenyl-4,5-dihydro-1,3-oxazol-2-amine
- English name
- N-Phenyl-4,5-dihydrooxazol-2-amine
- Molecular formula
- C9H10N2O
- Molecular weight
- 162.19
Names & synonyms
2-Anilino-2-oxazolineANILINE, N-(2-OXAZOLIN-2-YL)-N-(2-Oxazolinyl)aniline27151-01-52-PhenyliminooxazolidineTYG70FN2WEOxazole, 4,5-dihydro-2-phenylamino-NSC 160004UNII-TYG70FN2WENSC-160004DTXSID301816192-OXAZOLINE, 2-ANILINO-
Show more names
N-Phenyl-4,5-dihydrooxazol-2-amine
2-N-PHENYLAMINO-2-OXAZOLINEOXAZOLIDINE, 2-(PHENYLIMINO)-2-Oxazolamine, 4,5-dihydro-N-phenyl-2-(PHENYLIMINO)-1,3-OXAZOLIDINE4,5-DIHYDRO-N-PHENYL-2-OXAZOLAMINERefChem:197928DTXCID20104110N-phenyl-4,5-dihydro-1,3-oxazol-2-amine
Database identifiers
- CAS
27151-01-5- PubChem CID
- 33718
- DTXSID
DTXSID30181619- ChEMBL
CHEMBL498826- UNII
- TYG70FN2WE
- Nikkaji
- J914.302E
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 33.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 173
Physicochemical properties
- Melting point
- 108 · 108-114 °C(Solv: heptane (142-82-5))
- Boiling point
- 249.3 · 249.3±23.0 °C(Predicted)
- Density
- 1.19 · 1.19±0.1 g/cm3(Predicted)
- pka
- 8.11 · 8.11±0.50(Predicted)
- FDA UNII
- 70 FN2WE · TYG70FN2WE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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