Allyl ether
Properties
- Molecular formula
- C6H10O
- Molar mass
- 98.14 g/mol
- Exact mass
- 98.0732 Da
- Density
- 0.8449 g/mL (at 0 °C)
- Melting point
- −6 °C
- Boiling point
- 94 °C
- Flash point
- -6.7 °C
- logP
- 1.38Crippen estimate
- Polar surface area
- 9.2 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 4
Hazards
Danger
- H225 Highly Flammable liquid and vapor100% of notifiers
- H302 Harmful if swallowed100% of notifiers
- H311 Toxic in contact with skin100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled97.5% of notifiers
- H335 May cause respiratory irritation97.5% of notifiers
Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P262, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
557-40-4SMILES
C=CCOCC=CInChIKey
ATVJXMYDOSMEPO-UHFFFAOYSA-NInChI
InChI=1S/C6H10O/c1-3-5-7-6-4-2/h3-4H,1-2,5-6H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
9 names
- 1-Propene, 3,3′-oxybis-
- 3,3′-Oxybis[1-propene]
- Diallyl ether
- 4-Oxahepta-1,6-diene
- 3-(Allyloxy)-1-propene
- Bis(allyl) ether
- 3,3′-Oxybis-1-propene
- NSC 7619
- 3-(2-Propenoxy)-1-propene
Work with Allyl ether
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-Ethoxy-1-propene557-31-361 % similar
Ethylene glycol monoallyl ether111-45-555 % similar
3-Propoxy-1-propene1471-03-055 % similar
Polyethylene glycol monoallyl ether27274-31-355 % similar
Allyl glycidyl ether106-92-352 % similar
Silicic acid (H4SiO4) tetra-2-propen-1-yl ester1067-43-250 % similar
Tetrakis(allyloxy)ethane16646-44-950 % similar
Boric acid (H3BO3) tri-2-propen-1-yl ester1693-71-650 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.