Basic information
- CAS
3866-00-0- Standard SMILES
CC(C)c1ccc(C2CN=C(N)O2)cc1- InChIKey
LGFOSLRPKMZENU-UHFFFAOYSA-N- Molecular formula
- C12H16N2O
- Average molar mass
- 204.27 g/mol
- Monoisotopic mass
- 204.12626314
Names & identifiers
- Preferred name
- 4,5-Dihydro-5-[4-(1-methylethyl)phenyl]-2-oxazolamine
- IUPAC
- 5-(4-propan-2-ylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Names & synonyms
3866-00-0DTXSID001213955AKOS0149241454,5-Dihydro-5-[4-(1-methylethyl)phenyl]-2-oxazolamine5-[4-(Propan-2-yl)phenyl]-4,5-dihydro-1,3-oxazol-2-amine
Database identifiers
- CAS
3866-00-0- PubChem CID
- 65585563
- DTXSID
DTXSID001213955
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 242
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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