1,2-Dichloropentane
Properties
- Molecular formula
- C5H10Cl2
- Molar mass
- 141.03 g/mol
- Exact mass
- 140.0160 Da
- Density
- 1.0767 g/mL (at 25 °C)
- Boiling point
- 148.3 °C
- logP
- 2.63Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 3
Hazards
Danger
- H226 Flammable liquid and vapor100% of notifiers
- H302 Harmful if swallowed100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H318 Causes serious eye damage100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
1674-33-5SMILES
CCCC(Cl)CClInChIKey
PPLBPDUKNRCHGG-UHFFFAOYSA-NInChI
InChI=1S/C5H10Cl2/c1-2-3-5(7)4-6/h5H,2-4H2,1H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
2 names
- Pentane, 1,2-dichloro-
- 1,2-Dichloro-n-pentane
Work with 1,2-Dichloropentane
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
1,2-Dichlorobutane616-21-755 % similar
1,2,3-Trichloropropane96-18-453 % similar
(±)-2,3-Dichloro-1-propanol616-23-942 % similar
3-(Chloromethyl)heptane123-04-639 % similar
16,17-Dichloroheptadecanoic acid116409-75-735 % similar
2-Methylpentane107-83-535 % similar
4-Methylheptane589-53-735 % similar
Butane106-97-833 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds