2-Chloroethanol
Properties
- Molecular formula
- C2H5ClO
- Molar mass
- 80.51 g/mol
- Exact mass
- 80.0029 Da
- Density
- 1.197 g/mL (at 20 °C)
- Melting point
- −67.5 °C
- Boiling point
- 128–130 °C
- pKa
- 14.31 (25 °C)
- Flash point
- 60 °C (closed cup)
- Water solubility
- miscible
- logP
- 0.22Crippen estimate
- Polar surface area
- 20.2 Ų
- H-bond donors / acceptors
- 1 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H300 Fatal if swallowedAcute toxicity, oral
- H310 Fatal in contact with skinAcute toxicity, dermal
- H330 Fatal if inhaledAcute toxicity, inhalation
Harmonised EU classification (CLP Annex VI), via PubChem.
Precautionary statements
P260, P262, P264, P270, P271, P280, P284, P301+P316, P302+P352, P304+P340, P316, P320, P321, P330, P361+P364, P403+P233, P405, P501
Identifiers
CAS number
107-07-3SMILES
OCCClInChIKey
SZIFAVKTNFCBPC-UHFFFAOYSA-NInChI
InChI=1S/C2H5ClO/c3-1-2-4/h4H,1-2H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
17 names · show all
- Ethanol, 2-chloro-
- β-Chloroethyl alcohol
- 2-Chloroethyl alcohol
- Ethylene chlorhydrin
- Ethylene chlorohydrin
- Glycol monochlorohydrin
- Ethylchlorohydrin
- β-Chloroethanol
- Chloroethanol
- β-Hydroxyethyl chloride
- 2-Chloro-1-ethanol
- 2-Hydroxyethyl chloride
- Ethene chlorohydrin
- Glycol chlorohydrin
- 2-Chloro-1-hydroxyethane
- 1-Chloro-2-hydroxyethane
- NSC 122289
Work with 2-Chloroethanol
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
3-Chloro-1-propanol627-30-560 % similar
4-Chloro-1-butanol928-51-856 % similar
6-Chloro-1-hexanol2009-83-853 % similar
8-Chloro-1-octanol23144-52-753 % similar
5-Chloro-1-pentanol5259-98-353 % similar
2-(Chloroethoxy)ethanol628-89-747 % similar
2-[(2-Chloroethoxy)ethoxy]ethanol5197-62-645 % similar
1,2-Dichloroethane107-06-242 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds