| Identification | Back Directory | [Name]
FEMA 2814 | [CAS]
7786-58-5 | [Synonyms]
FEMA 2814
ENT 30598
NSC 21891
OCTYL ISOVALERATE
n-Octyl-Isovalerate
Octyl 3-methyl butyrate
OCTYL ISOVALERATE 98+%
Octyl-3-methylbutanoate
n-Octyl-3-methyl butyrate
Isovaleric acid, octyl ester
Butanoic acid, 3-methyl-, octyl ester | [EINECS(EC#)]
232-100-7 | [Molecular Formula]
C13H26O2 | [MDL Number]
MFCD00072183 | [MOL File]
7786-58-5.mol | [Molecular Weight]
214.34 |
| Chemical Properties | Back Directory | [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) |
| Hazard Information | Back Directory | [Description]
Octyl isovalerate has a strong odor reminiscent of fatty aldehyde
with an apple-pineapple undertone. May be prepared by esterification
of n-octanol with isovaleric acid. | [Chemical Properties]
n-Octyl isovalerate has a strong odor reminiscent of fatty aldehyde with an apple–pineapple undertone. | [Occurrence]
Reported found among the volatile constituents of the aroma of fresh Florida orange juice and babaco fruit
(Carica pentagona Heilborn). | [Definition]
ChEBI: Octyl 3-methyl-butanoate is a carboxylic ester. | [Preparation]
By esterification of n-octanol with isovaleric acid. |
|
| Company Name: |
jiliang chemicals
|
| Tel: |
21-62165282 15801962796; |
| Website: |
http://www.jiliangchem.com |
| Company Name: |
Sigma-Aldrich
|
| Tel: |
021-61415566 800-8193336 |
| Website: |
https://www.sigmaaldrich.cn |
| Company Name: |
Merck KGaA
|
| Tel: |
21-20338288 |
| Website: |
www.sigmaaldrich.cn |
| Company Name: |
SRS Aromatics Ltd
|
| Tel: |
+44 (0) 1359 244760 |
| Website: |
www.srsaromatics.com |
|