Octyl isovalerate
ALDRICH/W281409 - ≥98%, FG
Synonym: n-Octyl-3-methyl butyrate
CAS Number: 7786-58-5
Empirical Formula (Hill Notation): C13H26O2
Molecular Weight: 214.34
EC Number: 232-100-7
MDL Number: MFCD00072183
Linear Formula: (CH3)2CHCH2CO2(CH2)7CH3
Product Type: Chemical
application(s) | flavors and fragrances |
assay | ≥98% |
biological source | synthetic |
bp | 249-251 °C (lit.) |
density | 0.862 g/mL at 25 °C (lit.) |
documentation | see Safety & Documentation for available documents |
food allergen | no known allergens |
grade | FG |
InChI | 1S/C13H26O2/c1-4-5-6-7-8- |
InChI key | FUBGRVHGQADOJI-UHFFFAOYSA |
organoleptic | honey; floral; rose |
Quality Level | 400 ![]() |
refractive index | n |
reg. compliance | EU Regulation 1334/2008 & 872/2012 |
SMILES string | CCCCCCCCOC(=O)CC(C)C |
Packaging: | 1 kg in poly bottle |
Packaging: | 4, 9 kg in poly drum |
RIDADR | NONH for all modes of transport |
WGK Germany | WGK 3 |
Flash Point(F) | Not applicable |
Flash Point(C) | Not applicable |
Purity | ≥98% |
bp | 249-251 °C (lit.) |
Density | 0.862 g/mL at 25 °C (lit.) |
Refractive Index | n |
FEMA Number | 2814 |
UNSPSC | 12164502 |