Basic information
- CAS
68441-67-8- Standard SMILES
CCCCCCC(=O)O.CCCCCCCC(=O)O.CCCCCCCCCC(=O)O.OCC(CO)(CO)CO- InChIKey
DZVDMBMUZJQKGH-UHFFFAOYSA-N- Molecular formula
- C30H62O10
- Average molar mass
- 582.8 g/mol
- Monoisotopic mass
- 582.43429817
Names & identifiers
- Preferred name
- 2,2-Bis(hydroxymethyl)propane-1,3-diol;decanoic acid;heptanoic acid;octanoic acid
- IUPAC
- 2,2-bis(hydroxymethyl)propane-1,3-diol;decanoic acid;heptanoic acid;octanoic acid
Names & synonyms
DZVDMBMUZJQKGH-UHFFFAOYSA-N
Database identifiers
- CAS
68441-67-8- PubChem CID
- 110259
Properties
Computed structural properties
- Topological polar surface area
- 193 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 23
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 330
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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