Basic information
- CAS
60999-41-9- Standard SMILES
OC(C1=CN2CCC1CC2)(c1ccccc1)c1ccccc1- InChIKey
CLTYGVKYRITDBH-UHFFFAOYSA-N- Molecular formula
- C20H21NO
- Average molar mass
- 291.4 g/mol
- Monoisotopic mass
- 291.16231429
Names & identifiers
- Preferred name
- 1-Azabicyclo(2.2.2)oct-2-ene-3-methanol, alpha,alpha-diphenyl-
- IUPAC
- 1-azabicyclo[2.2.2]oct-2-en-3-yl(diphenyl)methanol
Names & synonyms
60999-41-91-AZABICYCLO(2.2.2)OCT-2-ENE-3-METHANOL, alpha,alpha-DIPHENYL-Benzhydrol, alpha,alpha-(1-azabicyclo(2.2.2)oct-2-en-3-yl)-alpha,alpha-Diphenyl-1-azabicyclo(2.2.2)oct-2-ene-1-methanolDTXSID30209842RefChem:227602DTXCID80132333(1-Azabicyclo[2.2.2]oct-2-en-3-yl)di(phenyl)methanol
Database identifiers
- CAS
60999-41-9- PubChem CID
- 43521
- DTXSID
DTXSID30209842- Nikkaji
- J84.618J
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 23.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 391
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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