Allyl acrylate
Properties
- Molecular formula
- C6H8O2
- Molar mass
- 112.13 g/mol
- Exact mass
- 112.0524 Da
- Density
- 0.9441 g/mL (at 20 °C)
- Boiling point
- 122 °C
- Flash point
- 20.6 °C
- Water solubility
- 1–5 g/L (17.8 °C)
- logP
- 0.90Crippen estimate
- Polar surface area
- 26.3 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 3
Hazards
Danger
- H226 Flammable liquid and vapor13.3% of notifiers
- H311 Toxic in contact with skin13.3% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H330 Fatal if inhaled13.3% of notifiers
- H335 May cause respiratory irritation95.6% of notifiers
- H411 Toxic to aquatic life with long lasting effects86.7% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P260, P261, P262, P264, P264+P265, P270, P271, P273, P280, P284, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P316, P319, P320, P321, P332+P317, P337+P317, P361+P364, P362+P364, P370+P378, P391, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
999-55-3SMILES
C=CCOC(=O)C=CInChIKey
QTECDUFMBMSHKR-UHFFFAOYSA-NInChI
InChI=1S/C6H8O2/c1-3-5-8-6(7)4-2/h3-4H,1-2,5H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
6 names
- 2-Propenoic acid, 2-propen-1-yl ester
- Acrylic acid, allyl ester
- 2-Propenoic acid, 2-propenyl ester
- Allyl alcohol, acrylate
- Allyl 2-propenoate
- NSC 20945
Work with Allyl acrylate
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
Polyethylene glycol diacrylate26570-48-963 % similar
2-Propen-1-yl 2-butenoate20474-93-561 % similar
1,4-Butylene glycol diacrylate1070-70-858 % similar
1,6-Hexanediol diacrylate13048-33-456 % similar
Ethyl acrylate140-88-556 % similar
Allyl chloroformate2937-50-056 % similar
Oxydiethylene diacrylate4074-88-856 % similar
Pentaerythritol tetraacrylate4986-89-456 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds