Basic information
- CAS
55517-75-4- Standard SMILES
CCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCC)C1CCCCC1- InChIKey
SUJPBAUMCPFUIW-UHFFFAOYSA-N- Molecular formula
- C39H78
- Average molar mass
- 547 g/mol
- Monoisotopic mass
- 546.61035249
Names & identifiers
- Preferred name
- 17-Cyclohexyltritriacontane
- IUPAC
- tritriacontan-17-ylcyclohexane
- English name
- (1-Hexadecylheptadecyl)cyclohexane
- Molecular formula
- C39H78
- Molecular weight
- 547.04
Names & synonyms
17-CyclohexyltritriacontaneCyclohexane, (1-hexadecylheptadecyl)-55517-75-4DTXSID00304550RefChem:79162DTXCID30255682SUJPBAUMCPFUIW-UHFFFAOYSA-N(tritriacontan-17-yl)cyclohexane(1-Hexadecylheptadecyl)cyclohexaneNSC16626517-Cyclohexyltritriacontan(1-Hexadecylheptadecyl)cyclohexane #
Show more names
NSC-166265DB-246672
Database identifiers
- CAS
55517-75-4- PubChem CID
- 296265
- DTXSID
DTXSID00304550- Nikkaji
- J114.133C
Properties
Computed structural properties
- XLogP
- 20.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 31
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 401
Physicochemical properties
- Boiling point
- 534.87 °C · 534.87°C (estimate)
- Density
- 0.9137 · 0.9137 (estimate)
- refractive index
- 1.4681 · 1.4681 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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