Basic information
- CAS
25117-35-5- Standard SMILES
CCCCCCCCCCCCCC(C)CCCC- InChIKey
FRVYSTFGTANOHG-UHFFFAOYSA-N- Molecular formula
- C19H40
- Average molar mass
- 268.5 g/mol
- Monoisotopic mass
- 268.31300128
Names & identifiers
- Preferred name
- 5-Methyloctadecane
- IUPAC
- 5-methyloctadecane
- English name
- 5-Methyloctadecane
- Molecular formula
- C19H40
- Molecular weight
- 268.52
Names & synonyms
5-Methyloctadecane25117-35-5DTXSID401315802RefChem:1073153DTXCID101745688Octadecane, 5-methyl-5-Methyloctadecane #SCHEMBL100654SCHEMBL201252SCHEMBL1645283SCHEMBL5986445SCHEMBL6764178
Show more names
SCHEMBL28161483SCHEMBL28219919
Database identifiers
- CAS
25117-35-5- PubChem CID
- 520183
- DTXSID
DTXSID401315802- Nikkaji
- J110.777A
Properties
Computed structural properties
- XLogP
- 10.2
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 15
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 150
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Melting point
- 4.77 °C · 4.77°C (estimate)
- Boiling point
- 322.58 °C · 322.58°C (estimate)
- Density
- 0.7797 · 0.7797 (estimate)
- refractive index
- 1.4313 · 1.4313 (estimate)
- LogP
- 10.67 · 10.670 (est)
Chemistry & industry
Suppliers1 total
大赛璐药物手性技术（上海）有限公司021-50460086-9 15921403865 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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