Basic information
- CAS
4443-61-2- Standard SMILES
CCCCCCCCCCCC(CCCCCCCC)C1CCCCC1- InChIKey
HFHMPSMIEOIWQO-UHFFFAOYSA-N- Molecular formula
- C26H52
- Average molar mass
- 364.7 g/mol
- Monoisotopic mass
- 364.40690166
Names & identifiers
- Preferred name
- Eicosane, 9-cyclohexyl-
- IUPAC
- icosan-9-ylcyclohexane
- English name
- 9-cyclohexylicosane
- Molecular formula
- C26H52
- Molecular weight
- 364.69
Names & synonyms
Eicosane, 9-cyclohexyl-9-CYCLOHEXYLEICOSANE4443-61-2Cyclohexane, (1-octyldodecyl)-NSC 219881RefChem:136393HFHMPSMIEOIWQO-UHFFFAOYSA-NNSC219881(1-Octyldodecyl)cyclohexane #NSC-2198819-cyclohexylicosane
Database identifiers
- CAS
4443-61-2- PubChem CID
- 20512
- Nikkaji
- J129.620E
Properties
Computed structural properties
- XLogP
- 13.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 18
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 263
Physicochemical properties
- Melting point
- 40.85 °C · 40.85°C
- Boiling point
- 410.83 °C · 410.83°C (estimate)
- Density
- 0.8199 · 0.8199 (estimate)
- refractive index
- 1.4541 · 1.4541 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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