Basic information
- CAS
20222-25-7- Standard SMILES
CCN(CC)CCOC1C=C(C)C2CC1C2(C)C- InChIKey
QCUBPXJGRLGDLG-UHFFFAOYSA-N- Molecular formula
- C16H29NO
- Average molar mass
- 251.41 g/mol
- Monoisotopic mass
- 251.22491455
Names & identifiers
- Preferred name
- N,N-diethyl-2-[(4,6,6-trimethyl-2-bicyclo[3.1.1]hept-3-enyl)oxy]ethanamine
- IUPAC
- N,N-diethyl-2-[(4,6,6-trimethyl-2-bicyclo[3.1.1]hept-3-enyl)oxy]ethanamine
Names & synonyms
20222-25-7NSC358956N,N-diethyl-2-[(4,6,6-trimethyl-2-bicyclo[3.1.1]hept-3-enyl)oxy]ethanamineDTXSID80320399NSC-358956N,N-Diethyl-2-[(4,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-yl)oxy]ethan-1-amine
Database identifiers
- CAS
20222-25-7- PubChem CID
- 338087
- DTXSID
DTXSID80320399
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 317
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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