Basic information
- CAS
10593-99-4- Standard SMILES
CCCCCCCCCCOC(=O)C1CCCCC1C(=O)OCCCCCCCCCC- InChIKey
ITKVMAXLADRPIZ-UHFFFAOYSA-N- Molecular formula
- C28H52O4
- Average molar mass
- 452.7 g/mol
- Monoisotopic mass
- 452.38656014
Names & identifiers
- Preferred name
- 1,2-Cyclohexanedicarboxylic acid, didecyl ester
- IUPAC
- didecyl cyclohexane-1,2-dicarboxylate
Names & synonyms
1,2-Cyclohexanedicarboxylic acid, didecyl ester10593-99-4DTXSID10343915RefChem:215747DTXCID90294991didecyl cyclohexane-1,2-dicarboxylateQSPL 131SCHEMBL1169555ITKVMAXLADRPIZ-UHFFFAOYSA-NDidecyl 1,2-cyclohexanedicarboxylate #
Database identifiers
- CAS
10593-99-4- PubChem CID
- 593102
- DTXSID
DTXSID10343915- Nikkaji
- J160.539I
Properties
Computed structural properties
- XLogP
- 10.5
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 22
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 420
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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