539-88-8

Name Ethyl levulinate
CAS 539-88-8
EINECS(EC#) 208-728-2
Molecular Formula C7H12O3
MDL Number MFCD00009209
Molecular Weight 144.17
MOL File 539-88-8.mol

Chemical Properties

Appearance clear yellowish liquid
Melting point  <25 °C
Boiling point  93-94 °C/18 mmHg (lit.)
density  1.016 g/mL at 25 °C(lit.)
vapor pressure  11Pa at 25℃
FEMA  2442
refractive index  n20/D 1.422(lit.)
Fp  195 °F
storage temp.  Sealed in dry,Room Temperature
solubility  H2O: freely soluble
form  Liquid
color  Clear yellow
Specific Gravity 1.01
Odor at 100.00 %. sweet fruity floral berry green pineapple rhubarb
biological source synthetic
Odor Type fruity
Water Solubility  Soluble in water.
Detection Methods GC,NMR
JECFA Number 607
Merck  14,3819
BRN  507641
Dielectric constant 12.0(21℃)
Major Application flavors and fragrances
Cosmetics Ingredients Functions SKIN CONDITIONING - EMOLLIENT
PERFUMING
SOLVENT
InChI 1S/C7H12O3/c1-3-10-7(9)5-4-6(2)8/h3-5H2,1-2H3
InChIKey GMEONFUTDYJSNV-UHFFFAOYSA-N
SMILES CCOC(=O)CCC(C)=O
LogP 0.324 at 20℃
Surface tension 33.25mN/m at 293.15K
Uses
Solvent for cellulose acetate and starch ethers, flavoring.
CAS DataBase Reference 539-88-8(CAS DataBase Reference)
NIST Chemistry Reference Pentanoic acid, 4-oxo-, ethyl ester(539-88-8)
EPA Substance Registry System 539-88-8(EPA Substance)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313
Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S24/25:Avoid contact with skin and eyes .
WGK Germany  2
RTECS  OI1700000
Hazard Note  Irritant
TSCA  Yes
HS Code  29183000
Storage Class 10 - Combustible liquids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
Safety Profile
A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes

Hazard Information

Material Safety Data Sheet(MSDS)

Well-known Reagent Company Product Information

Supplier