Basic information
- CAS
20395-24-8- Standard SMILES
CCCCCCCC(Cl)Cl- InChIKey
OQYNFBPKTVQOKO-UHFFFAOYSA-N- Molecular formula
- C8H16Cl2
- Average molar mass
- 183.12 g/mol
- Monoisotopic mass
- 182.0629059
Names & identifiers
- Preferred name
- 1,1-Dichlorooctane
- IUPAC
- 1,1-dichlorooctane
- English name
- 1,1-dichlorooctane
- Molecular formula
- C8H16Cl2
- Molecular weight
- 183.12
Names & synonyms
1,1-DICHLOROOCTANE20395-24-8DTXSID50174341RefChem:71045DTXCID7096832OQYNFBPKTVQOKO-UHFFFAOYSA-N1,1-dichloro-octaneoctane dichlorideSCHEMBL154425SCHEMBL3853521SCHEMBL8837346Octane, 1,1-dichloro-
Database identifiers
- CAS
20395-24-8- PubChem CID
- 30140
- DTXSID
DTXSID50174341- Nikkaji
- J97.447A
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 6
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 62.3
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Melting point
- 6.2 °C · 6.2°C (estimate)
- Boiling point
- 221.51 °C · 221.51°C (estimate)
- Density
- 1.0333 · 1.0333 (estimate)
- refractive index
- 1.4351 · 1.4351 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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