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Caproic acid propyl ester Structure

Caproic acid propyl ester

  • Product NameCaproic acid propyl ester
  • CAS626-77-7
  • CBNumberCB1173240
  • MFC9H18O2
  • MW158.24
  • EINECS210-963-0
  • MDL NumberMFCD00053803
  • MOL File626-77-7.mol

Chemical Properties

Melting point: −68 °C (−90 °F; 205 K)
Boiling point: 186 °C (367 °F; 459 K)
Density  0.87
refractive index  1.41
FEMA  2949 | PROPYL HEXANOATE
Flash point: 52 °C
storage temp.  Sealed in dry,Room Temperature
solubility  Almost insoluble in water, soluble in alcohol and oils.
form  Clear liquid
color  colorless
Odor at 10.00 % in dipropylene glycol. sweet fruity juicy pineapple green tropical
Odor Type fruity
biological source synthetic
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 Propyl hexanoate (626-77-7)

Safety

Symbol(GHS)  Flame (GHS02)
GHS02
Signal word  Warning
Hazard statements  H226
Precautionary statements  P210-P240-P241-P280a-P303+P361+P353-P501a
PPE Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Risk Statements  10
Safety Statements  16
RIDADR  UN 3272 3/PG 3
WGK Germany  3
TSCA  TSCA listed
HazardClass  3.2
PackingGroup  III
HS Code  2915900090
Storage Class 3 - Flammable liquids
Hazard Classifications Flam. Liq. 3
NFPA 704:
2
0 0

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Caproic acid propyl ester Chemical Properties,Usage,Production

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