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Ethyl heptanoate  Structure

Ethyl heptanoate

Chemical Properties

Melting point −66 °C (−87 °F; 207 K)
Boiling point 188 to 189 °C (370 to 372 °F; 461 to 462 K)
Density  0.860 g/cm3
vapor pressure  4.27hPa at 20℃
FEMA  2437 | ETHYL HEPTANOATE
refractive index  1.41
Flash point 71 °C
storage temp.  Sealed in dry,Room Temperature
solubility  Insoluble in water
form  liquid
color  Colorless
Odor at 100.00 %. fruity pineapple cognac rum wine
Odor Type fruity
biological source synthetic
Water Solubility  126mg/L at 20℃
Merck  14,3835
JECFA Number 32
BRN  1752311
Henry's Law Constant 2.0×10-2 mol/(m3Pa) at 25℃, Meylan and Howard (1991)
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C9H18O2/c1-3-5-6-7-8-9(10)11-4-2/h3-8H2,1-2H3
InChIKey TVQGDYNRXLTQAP-UHFFFAOYSA-N
SMILES CCCCCCC(=O)OCC
LogP 3.98 at 20℃
CAS DataBase Reference 106-30-9(CAS DataBase Reference)
NIST Chemistry Reference Heptanoic acid, ethyl ester(106-30-9)
EPA Substance Registry System Heptanoic acid, ethyl ester (106-30-9)

Safety Information

Hazard Codes  Xi
Risk Statements  36/37/38-22
Safety Statements  37/39-26-24/25
RIDADR  UN 1993 / PGIII
WGK Germany  1
RTECS  MJ2087000
TSCA  TSCA listed
HS Code  2915900090
Storage Class 10 - Combustible liquids
Toxicity LD50 orally in rats: >34640 mg/kg (Jenner)

MSDS

Usage And Synthesis

Preparation Products And Raw materials

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