Basic information
- CAS
23293-64-3- Standard SMILES
COC(=O)CCCCCCCCCCC(=O)c1ccc(CO)cc1- InChIKey
UFGYURZRTUENSM-UHFFFAOYSA-N- Molecular formula
- C20H30O4
- Average molar mass
- 334.4 g/mol
- Monoisotopic mass
- 334.21440943
Names & identifiers
- Preferred name
- Methyl 12-[4-(hydroxymethyl)phenyl]-12-oxododecanoate
- IUPAC
- methyl 12-[4-(hydroxymethyl)phenyl]-12-oxododecanoate
Names & synonyms
23293-64-3methyl 12-[4-(hydroxymethyl)phenyl]-12-oxododecanoateNSC132297DTXSID10299721NSC-132297
Database identifiers
- CAS
23293-64-3- PubChem CID
- 280552
- DTXSID
DTXSID10299721
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 14
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 346
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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