Basic information
- CAS
21548-53-8- Standard SMILES
CCc1cccc(CC)c1NC1=NCCO1- InChIKey
XCCYBZIZVOJGCL-UHFFFAOYSA-N- Molecular formula
- C13H18N2O
- Average molar mass
- 218.29 g/mol
- Monoisotopic mass
- 218.1419132
Names & identifiers
- Preferred name
- Aniline, 2,6-diethyl-N-(2-oxazolin-2-yl)-
- IUPAC
- N-(2,6-diethylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Names & synonyms
2-(2,6-Diethylanilino)-2-oxazolineANILINE, 2,6-DIETHYL-N-(2-OXAZOLIN-2-YL)-21548-53-82,6-Diethyl-N-(2-oxazolin-2-yl)anilineDTXSID40175882RefChem:319584DTXCID7098373N-(2,6-diethylphenyl)-4,5-dihydro-1,3-oxazol-2-amineCHEMBL2286080
Database identifiers
- CAS
21548-53-8- PubChem CID
- 30685
- DTXSID
DTXSID40175882- ChEMBL
CHEMBL2286080- Nikkaji
- J767.445G
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 33.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 240
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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