Basic information
- CAS
77733-19-8- Standard SMILES
Cc1cc(C)c(NC2=NCCO2)cc1C- InChIKey
BBYVJEYEEJDLKD-UHFFFAOYSA-N- Molecular formula
- C12H16N2O
- Average molar mass
- 204.27 g/mol
- Monoisotopic mass
- 204.12626314
Names & identifiers
- Preferred name
- Aniline, N-(2-oxazolin-2-yl)-2,4,5-trimethyl-
- IUPAC
- N-(2,4,5-trimethylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Names & synonyms
2-(2,4,5-Trimethylanilino)-2-oxazolineANILINE, N-(2-OXAZOLIN-2-YL)-2,4,5-TRIMETHYL-77733-19-8N-(2-Oxazolin-2-yl)-2,4,5-trimethylanilineDTXSID10228354RefChem:319637DTXCID30150845N-(2,4,5-trimethylphenyl)-4,5-dihydro-1,3-oxazol-2-amine
Database identifiers
- CAS
77733-19-8- PubChem CID
- 53737
- DTXSID
DTXSID10228354
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 33.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 252
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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