Basic information
- CAS
64028-66-6- Standard SMILES
CCOC1=NC=CC=CC1- InChIKey
UMSUSYOMNYRZIT-UHFFFAOYSA-N- Molecular formula
- C8H11NO
- Average molar mass
- 137.18 g/mol
- Monoisotopic mass
- 137.08406397
Names & identifiers
- Preferred name
- 2-Ethoxy-3H-azepine
- IUPAC
- 2-ethoxy-3H-azepine
Names & synonyms
2-Ethoxy-3H-azepine64028-66-6DTXSID80494923RefChem:260321DTXCID80445733
Database identifiers
- CAS
64028-66-6- PubChem CID
- 12372772
- DTXSID
DTXSID80494923
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 21.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 180
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…