Acryloyl chloride
Properties
- Molecular formula
- C3H3ClO
- Molar mass
- 90.51 g/mol
- Exact mass
- 89.9872 Da
- Density
- 1.1136 g/mL (at 20 °C)
- Melting point
- 76 °C
- Boiling point
- 75 °C
- Flash point
- 14 °C (closed cup)
- logP
- 0.94Crippen estimate
- Polar surface area
- 17.1 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Hazards
Danger
- H225 Highly Flammable liquid and vapor100% of notifiers
- H290 May be corrosive to metals67.1% of notifiers
- H302+H312 Harmful if swallowed or in contact with skin65.8% of notifiers
- H302 Harmful if swallowed74.7% of notifiers
- H312 Harmful in contact with skin67.7% of notifiers
- H314 Causes severe skin burns and eye damage100% of notifiers
- H318 Causes serious eye damage67.1% of notifiers
- H330 Fatal if inhaled100% of notifiers
- H400 Very toxic to aquatic life67.7% of notifiers
Aggregated from 158 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P234, P240, P241, P242, P243, P260, P264, P264+P265, P270, P271, P273, P280, P284, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P320, P321, P330, P362+P364, P363, P370+P378, P390, P391, P403+P233, P403+P235, P405, P406, P501
Identifiers
CAS number
814-68-6SMILES
C=CC(=O)ClInChIKey
HFBMWMNUJJDEQZ-UHFFFAOYSA-NInChI
InChI=1S/C3H3ClO/c1-2-3(4)5/h2H,1H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
6 names
- 2-Propenoyl chloride
- Acrylyl chloride
- Acrylic acid chloride
- Propenoyl chloride
- NSC 93770
- A 0147
Work with Acryloyl chloride
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
Fumaryl chloride627-63-450 % similar
2-Butenoyl chloride10487-71-541 % similar
trans-Crotonyl chloride625-35-441 % similar
3-Methyl-2-butenoyl chloride3350-78-539 % similar
Chloroprene126-99-838 % similar
Neoprene9010-98-438 % similar
1-Penten-3-one1629-58-938 % similar
Acrylic anhydride2051-76-536 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.