Basic information
- Standard SMILES
CC(C)CCCC(C)CCCC(C)CCCC(C)CCOC(=O)Cl- InChIKey
JESRMWUHKXIIHW-UHFFFAOYSA-N- Molecular formula
- C21H41ClO2
- Average molar mass
- 361 g/mol
- Monoisotopic mass
- 360.2795082
Names & identifiers
- Preferred name
- 3,7,11,15-Tetramethyl-hexadecyl chloroformate
- IUPAC
- 3,7,11,15-tetramethylhexadecyl carbonochloridate
Names & synonyms
phytanyl chloroformateSCHEMBL2787526JESRMWUHKXIIHW-UHFFFAOYSA-N3,7,11,15-Tetramethyl-hexadecyl chloroformate
Database identifiers
- PubChem CID
- 58538503
Properties
Computed structural properties
- XLogP
- 10.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 16
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 304
Related reactions
4 records
Compound notes
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