Bicyclo[3.1.0]hexane-2-undecanoic acid, methyl ester
Basic information
- CAS
10152-73-5- Standard SMILES
COC(=O)CCCCCCCCCCC1CCC2CC12- InChIKey
XFYKQHGWUWTHQK-UHFFFAOYSA-N- Molecular formula
- C18H32O2
- Average molar mass
- 280.4 g/mol
Names & identifiers
- Preferred name
- Bicyclo[3.1.0]hexane-2-undecanoic acid, methyl ester
- IUPAC
- methyl 11-(2-bicyclo[3.1.0]hexanyl)undecanoate
- English name
- Bicyclo[3.1.0]hexane-2-undecanoic acid methyl ester
- Molecular formula
- C18H32O2
- Molecular weight
- 280.45
Names & synonyms
Bicyclo[3.1.0]hexane-2-undecanoic acid methyl estermethyl 11-(2-bicyclo[3.1.0]hexanyl)undecanoate10152-73-5Bicyclo[3.1.0]hexane-2-undecanoic acid, methyl esterXFYKQHGWUWTHQK-UHFFFAOYSA-NMethyl 11-bicyclo[3.1.0]hex-2-ylundecanoate #
Database identifiers
- CAS
10152-73-5- Nikkaji
- J110.811E
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 12
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 287
Physicochemical properties
- Boiling point
- 339.9 · 339.9±10.0 °C(Predicted)
- Density
- 0.955 · 0.955±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…