2-(3-methoxyisoxazol-5-yl)-N-methylethanamine
Basic information
- CAS
687602-59-1- Standard SMILES
CNCCc1cc(OC)no1- InChIKey
SXTCSYCLYGETMJ-UHFFFAOYSA-N- Molecular formula
- C7H12N2O2
- Average molar mass
- 156.18 g/mol
- Monoisotopic mass
- 156.08987763
Names & identifiers
- Preferred name
- 2-(3-methoxyisoxazol-5-yl)-N-methylethanamine
- IUPAC
- 2-(3-methoxy-1,2-oxazol-5-yl)-N-methylethanamine
- English name
- 5-Isoxazoleethanamine,3-methoxy-N-methyl-(9CI)
- Molecular formula
- C7H12N2O2
- Molecular weight
- 156.18238
Names & synonyms
2-(3-methoxyisoxazol-5-yl)-N-methylethanamine687602-59-1[2-(3-methoxy-1,2-oxazol-5-yl)ethyl](methyl)amineEN300-18563585-Isoxazoleethanamine,3-methoxy-N-methyl-(9CI)
Database identifiers
- CAS
687602-59-1- PubChem CID
- 45099112
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 47.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 111
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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