7786-58-5

Name FEMA 2814
CAS 7786-58-5
EINECS(EC#) 232-100-7
Molecular Formula C13H26O2
MDL Number MFCD00072183
Molecular Weight 214.34
MOL File 7786-58-5.mol
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Chemical Properties

Melting point  -42.3°C (estimate)
Boiling point  249-251 °C(lit.)
density  0.862 g/mL at 25 °C(lit.)
FEMA  2814 | OCTYL ISOVALERATE
refractive index  n20/D 1.425(lit.)
Fp  >230 °F
Odor at 100.00 %. mild warm floral rose honey apple pineapple
biological source synthetic
Odor Type floral
JECFA Number 200
Major Application flavors and fragrances
InChI 1S/C13H26O2/c1-4-5-6-7-8-9-10-15-13(14)11-12(2)3/h12H,4-11H2,1-3H3
InChIKey FUBGRVHGQADOJI-UHFFFAOYSA-N
SMILES CCCCCCCCOC(=O)CC(C)C
LogP 5.31
EPA Substance Registry System Octyl isovalerate (7786-58-5)

Safety Data

WGK Germany  3
TSCA  TSCA listed
Storage Class 12 - Non Combustible Liquids

Hazard Information

Spectrum Detail

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