Basic information
- CAS
10152-65-5- Standard SMILES
CCCCCCCCC1CC1CCCCCCCCCCCC(=O)OC- InChIKey
URVGGUJSLHSPFY-UHFFFAOYSA-N- Molecular formula
- C24H46O2
- Average molar mass
- 366.6 g/mol
- Monoisotopic mass
- 366.34978071
Names & identifiers
- Preferred name
- Methyl 12-(2-octylcyclopropyl)dodecanoate
- IUPAC
- methyl 12-(2-octylcyclopropyl)dodecanoate
- English name
- 2-Octylcyclopropanedodecanoic acid methyl ester
- Molecular formula
- C24H46O2
- Molecular weight
- 366.62
Names & synonyms
Methyl 12-(2-octylcyclopropyl)dodecanoate10152-65-5DTXSID90336562RefChem:353445DTXCID402876512-Octylcyclopropanedodecanoic acid methyl esterCyclopropanedodecanoic acid, 2-octyl-, methyl esterURVGGUJSLHSPFY-UHFFFAOYSA-NMethyl 12-(2-octylcyclopropyl)dodecanoate #
Database identifiers
- CAS
10152-65-5- PubChem CID
- 534597
- DTXSID
DTXSID90336562- Nikkaji
- J110.806I
Properties
Computed structural properties
- XLogP
- 10.4
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 20
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 326
Physicochemical properties
- Boiling point
- 414.4 · 414.4±13.0 °C(Predicted)
- Density
- 0.888 · 0.888±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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