Basic information
- CAS
4443-58-7- Standard SMILES
CCCCCCCCCCCCCCCCC(CCC)C1CCCCC1- InChIKey
IBXHOJGRWDXKSM-UHFFFAOYSA-N- Molecular formula
- C26H52
- Average molar mass
- 364.7 g/mol
- Monoisotopic mass
- 364.40690166
Overview
4-Cyclohexyleicosane has been reported in Houttuynia cordata with data available.
Names & identifiers
- Preferred name
- 4-Cyclohexyleicosane
- IUPAC
- icosan-4-ylcyclohexane
- English name
- 4-Cyclohexylicosane
- Molecular formula
- C26H52
- Molecular weight
- 0
Names & synonyms
4-CyclohexyleicosaneEicosane, 4-cyclohexyl-Cyclohexane, (1-propylheptadecyl)-4443-58-7DTXSID20303929icosan-4-ylcyclohexaneRefChem:98672DTXCID30255061IBXHOJGRWDXKSM-UHFFFAOYSA-N(icosan-4-yl)cyclohexaneNSC163590(1-Propylheptadecyl)cyclohexane #
Show more names
4-Cyclohexylicosane4-cyclohexyl-eicosane
NSC-163590
Database identifiers
- CAS
4443-58-7- PubChem CID
- 294706
- DTXSID
DTXSID20303929- Nikkaji
- J129.618C
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
- 22.36 °C · 22.36°C (estimate)
- Boiling point
- 410.83 °C · 410.83°C (estimate)
- Density
- 0.8199 · 0.8199 (estimate)
- refractive index
- 1.4486 · 1.4486 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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