Octylcyclohexane
Basic information
- CAS
1795-15-9- Standard SMILES
CCCCCCCCC1CCCCC1- InChIKey
FBXWCEKQCVOOLT-UHFFFAOYSA-N- Molecular formula
- C14H28
- Average molar mass
- 196.37 g/mol
- Monoisotopic mass
- 196.21910089
Overview
1-Cyclohexyloctane is a cycloalkane.
Names & identifiers
- Preferred name
- Octylcyclohexane
- IUPAC
- octylcyclohexane
- English name
- N-OCTYLCYCLOHEXANE
- Molecular formula
- C14H28
- Molecular weight
- 196.37
Names & synonyms
n-OctylcyclohexaneOctylcyclohexaneCyclohexane, octyl-1-CYCLOHEXYLOCTANEOctane, 1-cyclohexyl-WN5PG18MPDCyclohexane, n-octyl-EINECS 217-271-8UNII-WN5PG18MPDNSC 174942NSC-174942DTXSID3061972
Show more names
octyl-cyclohexancyclohexane,octyl-octane,1-cyclohexyln-Octylcyclohexane>n-Octylcyclohexane
nOctylcyclohexane1CyclohexyloctaneCyclohexane, octylOctane, 1cyclohexylRefChem:167907Octane, 1cyclohexyl (8CI)Octane, 1-cyclohexyl-(8CI)DTXCID7035696
Database identifiers
- CAS
1795-15-9- PubChem CID
- 15712
- DTXSID
DTXSID3061972- ChEBI
CHEBI:207969- UNII
- WN5PG18MPD
- EC Number
- 217-271-8
- Nikkaji
- J144.906K
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 7
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 111
Experimental & physicochemical properties
Chemical ClassesOther Classes -> Aliphatics, Saturated (>C11)
SpringerMaterials PropertiesBoiling point
Physical DescriptionLiquid; [TCI America MSDS]
Physicochemical properties
- Melting point
- -19.69 °C · -19.69°C
- Boiling point
- 264 °C · 264 °C
- Density
- 0.81 · 0.81
- refractive index
- 1.45 · 1.4500-1.4520
- form
- clear liquid
- color
- Colorless to Almost colorless
- Henry's Law Constant
- 3.1 · 3.1×10-5 mol/(m3Pa) at 25℃, Yaws (2003)
- CAS DataBase Reference
- 1795 · 1795-15-9
- FDA UNII
- 5 PG18MPD · WN5PG18MPD
- EPA Substance Registry System
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Hazards SummaryMay cause irritation; [TCI America MSDS] See Cyclohexane.
Safety data
- tsca
- TSCA listed
- hs_code
- 2902.19.0050
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationCyclohexane, octyl-: INACTIVE
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Related reactions
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Compound notes
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