1-Acetoxy-1,3-butadiene
Properties
- Molecular formula
- C6H8O2
- Molar mass
- 112.13 g/mol
- Exact mass
- 112.0524 Da
- Density
- 0.9643 g/mL (at 20 °C)
- Boiling point
- 52–54 °C (at 40 Torr)
- logP
- 1.25Crippen estimate
- Polar surface area
- 26.3 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 2
Hazards
Danger
- H226 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
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 43 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, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
1515-76-0SMILES
C=CC=COC(C)=OInChIKey
NMQQBXHZBNUXGJ-UHFFFAOYSA-NInChI
InChI=1S/C6H8O2/c1-3-4-5-8-6(2)7/h3-5H,1H2,2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
5 names
- 1,3-Butadien-1-ol, 1-acetate
- 1,3-Butadien-1-ol, acetate
- 1-Acetoxybutadiene
- 1,3-Butadienyl acetate
- Butadienyl acetate
Work with 1-Acetoxy-1,3-butadiene
Similar compounds
Vinyl acetate108-05-454 % similar
Polyvinyl acetate9003-20-754 % similar
Ethylene-vinyl acetate24937-78-850 % similar
Polyvinyl chloride acetate9003-22-944 % similar
1-Methoxy-1,3-butadiene3036-66-641 % similar
Vinyltriacetoxysilane4130-08-940 % similar
Allyl acetate591-87-739 % similar
Allylidene diacetate869-29-439 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds