Basic information
- CAS
59746-38-2- Standard SMILES
CCCCCCCCCN1CCCCCC1=O- InChIKey
OHQIBYGMOSXKPD-UHFFFAOYSA-N- Molecular formula
- C15H29NO
- Average molar mass
- 239.4 g/mol
- Monoisotopic mass
- 239.22491455
Names & identifiers
- Preferred name
- 1-Nonylazepan-2-one
- IUPAC
- 1-nonylazepan-2-one
Names & synonyms
1-NONYLAZEPAN-2-ONE59746-38-21-n-Nonylazacycloheptan-2-oneSCHEMBL9003902DTXSID90511039OHQIBYGMOSXKPD-UHFFFAOYSA-N
Database identifiers
- CAS
59746-38-2- PubChem CID
- 12833263
- DTXSID
DTXSID90511039
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 203
Related reactions
4 records
Compound notes
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