Basic information
- CAS
5330-62-1- Standard SMILES
CC1(C)C2CCC(CCOC(=O)c3ccccc3O)C1C2- InChIKey
GDPBFLNTKYRSFR-UHFFFAOYSA-N- Molecular formula
- C18H24O3
- Average molar mass
- 288.4 g/mol
- Monoisotopic mass
- 288.17254462
Names & identifiers
- Preferred name
- 2-(6,6-Dimethylbicyclo[3.1.1]heptan-2-yl)ethyl 2-hydroxybenzoate
- IUPAC
- 2-(6,6-dimethyl-2-bicyclo[3.1.1]heptanyl)ethyl 2-hydroxybenzoate
Names & synonyms
5330-62-1NSC2501DTXSID20277479NSC-25012-(6,6-Dimethylbicyclo[3.1.1]heptan-2-yl)ethyl 2-hydroxybenzoate2-HYDROXYBENZOIC ACID, 2-(2-NORPINYL)ETHYL ESTER
Database identifiers
- CAS
5330-62-1- PubChem CID
- 220165
- DTXSID
DTXSID20277479
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 390
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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