Hexahydro-1-methyl-2(1H)-azocinone
Basic information
- CAS
1889-08-3- Standard SMILES
CN1CCCCCCC1=O- InChIKey
IJRHFDHZRCNEJZ-UHFFFAOYSA-N- Molecular formula
- C8H15NO
- Average molar mass
- 141.21 g/mol
- Monoisotopic mass
- 141.1153641
Names & identifiers
- Preferred name
- Hexahydro-1-methyl-2(1H)-azocinone
- IUPAC
- 1-methylazocan-2-one
- English name
- 1-methylazocan-2-one
- Molecular formula
- C8H15NO
- Molecular weight
- 0
Names & synonyms
1-methylazocan-2-oneHexahydro-1-methyl-2(1H)-azocinone1889-08-3SCHEMBL8300693DTXSID801722592H-Azocin-2-one, hexahydro-1-methyl-
Database identifiers
- CAS
1889-08-3- PubChem CID
- 137248
- DTXSID
DTXSID80172259- Nikkaji
- J1.154.945D
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 122
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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