3-(2,5-Dichlorophenyl)-1,2-oxazol-5-amine
Basic information
- CAS
501902-21-2- Standard SMILES
Nc1cc(-c2cc(Cl)ccc2Cl)no1- InChIKey
SWTAMACZYTUWSP-UHFFFAOYSA-N- Molecular formula
- C9H6Cl2N2O
- Average molar mass
- 229.06 g/mol
- Monoisotopic mass
- 227.9857182
Names & identifiers
- Preferred name
- 3-(2,5-Dichlorophenyl)-1,2-oxazol-5-amine
- IUPAC
- 3-(2,5-dichlorophenyl)-1,2-oxazol-5-amine
Names & synonyms
3-(2,5-dichlorophenyl)-1,2-oxazol-5-amine501902-21-23-(2,5-Dichlorophenyl)isoxazol-5-amineDTXSID101277518AKOS0002620965-Isoxazolamine, 3-(2,5-dichlorophenyl)-CS-0283724EN300-1968458
Database identifiers
- CAS
501902-21-2- PubChem CID
- 3380233
- DTXSID
DTXSID101277518
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 205
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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