Basic information
- Standard SMILES
CCCCCCCCCCCCCCOc1ccc(C(=O)OCC(Cl)(Cl)Cl)o1- InChIKey
VMHBNNIGZNHCNG-UHFFFAOYSA-N- Molecular formula
- C21H33Cl3O4
- Average molar mass
- 455.8 g/mol
Names & identifiers
- Preferred name
- 2,2,2-Trichloroethyl 5-(tetradecyloxy)furan-2-carboxylate
- IUPAC
- 2,2,2-trichloroethyl 5-tetradecoxyfuran-2-carboxylate
Names & synonyms
SCHEMBL992096VMHBNNIGZNHCNG-UHFFFAOYSA-N2,2,2-trichloroethyl 5-(tetradecyloxy)furan-2-carboxylate
Database identifiers
- PubChem CID
- 49869898
Properties
Computed structural properties
- XLogP
- 10
- Topological polar surface area
- 48.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 17
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 402
Related reactions
2 records
Compound notes
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