1,6-Dichlorohexane
Properties
- Molecular formula
- C6H12Cl2
- Molar mass
- 155.06 g/mol
- Exact mass
- 154.0316 Da
- Density
- 1.0677 g/mL (at 20 °C)
- Boiling point
- 204 °C
- Flash point
- 73.9 °C
- logP
- 3.02Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 5
Hazards
Danger
- H304 May be fatal if swallowed and enters airways65.2% of notifiers
- H315 Causes skin irritation97.6% of notifiers
- H319 Causes serious eye irritation24.4% of notifiers
- H335 May cause respiratory irritation23.8% of notifiers
- H411 Toxic to aquatic life with long lasting effects73.2% of notifiers
Aggregated from 164 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P331, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501
Identifiers
CAS number
2163-00-0SMILES
ClCCCCCCClInChIKey
OVISMSJCKCDOPU-UHFFFAOYSA-NInChI
InChI=1S/C6H12Cl2/c7-5-3-1-2-4-6-8/h1-6H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
2 names
- Hexane, 1,6-dichloro-
- NSC 60700
Work with 1,6-Dichlorohexane
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
1,10-Dichlorodecane2162-98-3100 % similar
1,8-Dichlorooctane2162-99-4100 % similar
1,5-Dichloropentane628-76-2100 % similar
1,4-Dichlorobutane110-56-589 % similar
1,3-Dichloropropane142-28-970 % similar
1-Chlorodecane1002-69-360 % similar
1-Chlorooctane111-85-360 % similar
1-Chlorododecane112-52-760 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.