Basic information
- CAS
18128-25-1- Standard SMILES
c1ccc2c(c1)Cc1ccccc1CN(C13CC4CC(CC(C4)C1)C3)C2- InChIKey
CCFPDWPNHCCJCO-UHFFFAOYSA-N- Molecular formula
- C25H29N
- Average molar mass
- 343.5 g/mol
- Monoisotopic mass
- 343.22999993
Names & identifiers
- Preferred name
- Dibenz(c,f)azocine, 5,6,7,12-tetrahydro-6-(1-adamantyl)-
- IUPAC
- 11-(1-adamantyl)-10,12-dihydro-5H-benzo[d][2]benzazocine
Names & synonyms
Dibenz(c,f)azocine, 5,6,7,12-tetrahydro-6-(1-adamantyl)-5,6,7,12-Tetrahydro-6-(1-adamantyl)dibenz(c,f)azocine18128-25-1Dibenz(c,f)azocine, 6-(1-adamantyl)-5,6,7,12-tetrahydro-DTXSID20171089RefChem:337036DTXCID20935806-(Adamantan-1-yl)-5,6,7,12-tetrahydrodibenzo[c,f]azocine
Database identifiers
- CAS
18128-25-1- PubChem CID
- 64175
- DTXSID
DTXSID20171089
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 459
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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