Methyl anti-2,4-dimethylheptadecanoate
Basic information
- Standard SMILES
CCCCCCCCCCCCC[C@@H](C)C[C@H](C)C(=O)OC- InChIKey
UHCWUABNOYPDLR-MOPGFXCFSA-N- Molecular formula
- C20H40O2
- Average molar mass
- 312.5 g/mol
- Monoisotopic mass
- 312.30283051
Names & identifiers
- Preferred name
- Methyl anti-2,4-dimethylheptadecanoate
- IUPAC
- methyl (2S,4R)-2,4-dimethylheptadecanoate
Names & synonyms
DTXSID701376398methyl anti-2,4-dimethylheptadecanoate
Database identifiers
- PubChem CID
- 177844094
- DTXSID
DTXSID701376398
Properties
Computed structural properties
- XLogP
- 8.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 16
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 250
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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