Basic information
- CAS
30483-08-0- Standard SMILES
O=C1NC23CCCCC12CCCC3- InChIKey
VGMIKUAJJWNLSU-UHFFFAOYSA-N- Molecular formula
- C11H17NO
- Average molar mass
- 179.26 g/mol
- Monoisotopic mass
- 179.13101417
Names & identifiers
- Preferred name
- Octahydro-4a,8a-(epiminomethano)naphthalen-9-one
- IUPAC
- 11-azatricyclo[4.4.2.01,6]dodecan-12-one
- English name
- 8a,4a-(Iminomethano)naphthalen-10-one, octahydro- (8CI,9CI)
- Molecular formula
- C11H17NO
- Molecular weight
- 179.26
Names & synonyms
30483-08-0octahydro-4a,8a-(epiminomethano)naphthalen-9-oneNSC135310DTXSID10300189RCL T169730AKOS024321452NSC-135310RCL T1697308a,4a-(Iminomethano)naphthalen-10-one, octahydro- (8CI,9CI)
Database identifiers
- CAS
30483-08-0- PubChem CID
- 282140
- DTXSID
DTXSID10300189
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 247
Physicochemical properties
- Boiling point
- 372.7 · 372.7±11.0 °C(Predicted)
- Density
- 1.12 · 1.12±0.1 g/cm3(Predicted)
- pka
- 15.37 · 15.37±0.20(Predicted)
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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