626-77-7

Name Caproic acid propyl ester
CAS 626-77-7
EINECS(EC#) 210-963-0
Molecular Formula C9H18O2
MDL Number MFCD00053803
Molecular Weight 158.24
MOL File 626-77-7.mol
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Chemical Properties

Melting point  -69 °C (lit.)
Boiling point  187 °C (lit.)
density  0.867 g/mL at 25 °C(lit.)
FEMA  2949
refractive index  n20/D 1.412(lit.)
Fp  125 °F
storage temp.  2-8°C
solubility  Almost insoluble in water, soluble in alcohol and oils.
form  clear liquid
color  Colorless to Almost colorless
Odor at 10.00 % in dipropylene glycol. sweet fruity juicy pineapple green tropical
biological source synthetic
Odor Type fruity
JECFA Number 161
Major Application flavors and fragrances
InChI 1S/C9H18O2/c1-3-5-6-7-9(10)11-8-4-2/h3-8H2,1-2H3
InChIKey HTUIWRWYYVBCFT-UHFFFAOYSA-N
SMILES CCCCCC(=O)OCCC
LogP 3.37
CAS DataBase Reference 626-77-7(CAS DataBase Reference)
NIST Chemistry Reference Propyl caproate(626-77-7)
EPA Substance Registry System 626-77-7(EPA Substance)
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Safety Data

Symbol(GHS)  Flame (GHS02)
GHS02
Signal word  Warning
Hazard statements  H226
Precautionary statements  P210-P240-P241-P280a-P303+P361+P353-P501a
Risk Statements 
R10:Flammable.
Safety Statements 
S16:Keep away from sources of ignition-No smoking .
RIDADR  UN 3272 3/PG 3
WGK Germany  3
TSCA  Yes
HazardClass  3.2
PackingGroup  III
HS Code  29159000
Storage Class 3 - Flammable liquids
Hazard Classifications Flam. Liq. 3

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Material Safety Data Sheet(MSDS)

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