Chloroacetaldehyde
Properties
- Molecular formula
- C2H3ClO
- Molar mass
- 78.50 g/mol
- Exact mass
- 77.9872 Da
- Density
- 1.19 g/mL
- Melting point
- −16.3 °C
- Boiling point
- 85–86 °C
- Flash point
- 87.8 °C (closed cup)
- Water solubility
- miscible
- logP
- 0.42Crippen estimate
- Polar surface area
- 17.1 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H301 Toxic if swallowedAcute toxicity, oral
- H311 Toxic in contact with skinAcute toxicity, dermal
- H314 Causes severe skin burns and eye damageSkin corrosion/irritation
- H330 Fatal if inhaledAcute toxicity, inhalation
- H351 Suspected of causing cancerCarcinogenicity
- H400 Very toxic to aquatic lifeHazardous to the aquatic environment, acute hazard
Harmonised EU classification (CLP Annex VI), via PubChem.
Precautionary statements
P203, P260, P262, P264, P270, P271, P273, P280, P284, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P318, P320, P321, P330, P361+P364, P363, P391, P403+P233, P405, P501
Identifiers
CAS number
107-20-0SMILES
O=CCClInChIKey
QSKPIOLLBIHNAC-UHFFFAOYSA-NInChI
InChI=1S/C2H3ClO/c3-1-2-4/h2H,1H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
7 names
- Acetaldehyde, 2-chloro-
- Acetaldehyde, chloro-
- 2-Chloroacetaldehyde
- 2-Chloro-1-ethanal
- Monochloroacetaldehyde
- α-Chloroacetaldehyde
- 2-Chloroethanal
Work with Chloroacetaldehyde
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
1,4-Dichlorobut-2-ene110-57-640 % similar
cis-1,4-Dichloro-2-butene1476-11-540 % similar
Succinaldehyde638-37-940 % similar
1,4-Dichloro-2-butene764-41-040 % similar
Hexanedial1072-21-535 % similar
Glutaraldehyde111-30-835 % similar
Allyl chloride107-05-133 % similar
Propionaldehyde123-38-633 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds