106-30-9

Name Ethyl heptanoate
CAS 106-30-9
EINECS(EC#) 203-382-9
Molecular Formula C9H18O2
MDL Number MFCD00009538
Molecular Weight 158.24
MOL File 106-30-9.mol

Chemical Properties

Appearance clear colorless liquid
Melting point  -66 °C (lit.)
Boiling point  188-189 °C (lit.)
density  0.87 g/mL at 25 °C(lit.)
vapor pressure  4.27hPa at 20℃
FEMA  2437
refractive index  n20/D 1.412(lit.)
Fp  151 °F
storage temp.  Sealed in dry,Room Temperature
solubility  Insoluble in water
form  neat
color  Colorless to Almost colorless
Odor at 100.00 %. fruity pineapple cognac rum wine
biological source synthetic
Odor Type fruity
Water Solubility  126mg/L at 20℃
JECFA Number 32
Merck  14,3835
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 106-30-9(EPA Substance)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H227
Precautionary statements  P210e-P280a-P370+P378a-P501a-P210-P280-P370+P378-P403+P235-P501
Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
RIDADR  UN 1993 / PGIII
WGK Germany  1
RTECS  MJ2087000
TSCA  Yes
REACH Registrations Active
HS Code  29159080
Storage Class 10 - Combustible liquids
Safety Profile
Low toxicity by ingestion and skin contact. Flammable liquid when exposed to heat, sparks, or flame. When heated to decomposition it emits acrid smoke and irritating fumes.
Toxicity
LD50 orally in rats: >34640 mg/kg (Jenner)

Raw materials And Preparation Products

Hazard Information

Material Safety Data Sheet(MSDS)

Well-known Reagent Company Product Information

Supplier