Allyl acetate Structure

Allyl acetate

Chemical Properties

Melting point 6°C
Boiling point 103-104 °C (lit.)
Density  0.928 g/mL at 25 °C (lit.)
vapor pressure  27.2 hPa (20 °C)
refractive index  n20/D 1.404(lit.)
Flash point 44 °F
storage temp.  2-8°C
solubility  28g/l
form  Liquid
color  Clear colorless
Specific Gravity 0.928
explosive limit 2.1-13.0%(V)
Water Solubility  slightly
Specific Heat Capacity Cp(liquid): 1.84 J/(g·K), at 25℃
Merck  14,285
BRN  1742050
Henry's Law Constant 7.6×10-2 mol/(m3Pa) at 25℃, HSDB (2015)
InChI 1S/C5H8O2/c1-3-4-7-5(2)6/h3H,1,4H2,2H3
InChIKey FWZUNOYOVVKUNF-UHFFFAOYSA-N
SMILES CC(=O)OCC=C
LogP 0.970
CAS DataBase Reference 591-87-7(CAS DataBase Reference)
FDA UNII E4U5E5990I
NIST Chemistry Reference Acetic acid, 2-propenyl ester(591-87-7)
EPA Substance Registry System Acetic acid, 2-propen-1-yl ester (591-87-7)
UNSPSC Code 12352108
NACRES NA.23

Safety

Symbol(GHS) Flame (GHS02)Skull and Crossbones (GHS06)Health Hazard (GHS08)
Signal wordDanger
Hazard statements H330-H301-H312-H315-H319-H373-H225
Precautionary statements P501-P270-P240-P260-P210-P233-P243-P241-P242-P271-P264-P280-P284-P370+P378-P314-P337+P313-P305+P351+P338-P362+P364-P303+P361+P353-P332+P313-P301+P310+P330-P304+P340+P310-P403+P233-P403+P235-P405
Hazard Codes  F,T
Risk Statements  11-21-23/25-36-25
Safety Statements  16-26-36-45-27
RIDADR  UN 2333
WGK Germany  3
RTECS  AF1750000
Autoignition Temperature 705 °F
TSCA  TSCA listed
HazardClass  3
PackingGroup  II
HS Code  29153990
Storage Class 3 - Flammable liquids
Hazard Classifications Acute Tox. 2 Inhalation
Acute Tox. 3 Oral
Acute Tox. 4 Dermal
Eye Irrit. 2
Flam. Liq. 2
Hazardous Substances Data 591-87-7(Hazardous Substances Data)
Toxicity LD50: 0.13 g/kg orally in rats; 1.1 ml/kg dermally in rabbits (Smyth); LD50 in rats, mice (mg/kg): 142, 170 orally (Jenner)
NFPA 704:
3
3 0

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