≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488183559 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488183559 |
| Canonical Smiles | CCCC(=O)OC(C)(CCC=C(C)C)C=C |
| IUPAC Name | 3,7-dimethylocta-1,6-dien-3-yl butanoate |
| InChIKey | FHLGUOHLUFIAAA-UHFFFAOYSA-N |
| INCHI | 1S/C14H24O2/c1-6-9-13(15)16-14(5,7-2)11-8-10-12(3)4/h7,10H,2,6,8-9,11H2,1,3-5H3 |
| Isomeric SMILES | CCCC(=O)OC(C)(CCC=C(C)C)C=C |
| Molecular Weight | 224.34 |
| Reaxy-Rn | 1710120 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1710120&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Lipids and lipid-like molecules |
| Class | Prenol lipids |
| Subclass | Monoterpenoids |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Acyclic monoterpenoids |
| Alternative Parents | Fatty acid esters Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Acyclic monoterpenoid - Fatty acid ester - Fatty acyl - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as acyclic monoterpenoids. These are monoterpenes that do not contain a cycle. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 D1916016 | Certificate of Analysis | Jun 15, 2026 | L136469 |
| D1628078 | Certificate of Analysis | Jul 09, 2025 | L136469 |
| E2326763 | Certificate of Analysis | Mar 03, 2025 | L136469 |
| E2326770 | Certificate of Analysis | Mar 03, 2025 | L136469 |
| E2326875 | Certificate of Analysis | Mar 03, 2025 | L136469 |
| E2326896 | Certificate of Analysis | Mar 03, 2025 | L136469 |
| E2326906 | Certificate of Analysis | Mar 03, 2025 | L136469 |
| E2327308 | Certificate of Analysis | Mar 03, 2025 | L136469 |
| E2327309 | Certificate of Analysis | Mar 03, 2025 | L136469 |
| Refractive Index | 1.45(lit.) |
|---|---|
| Specific Rotation[α] | -8.9° (neat)(lit.) |
| Boil Point(°C) | 80-82 °C/0.2 mmHg(lit.) |
| Molecular Weight | 224.340 g/mol |
| XLogP3 | 4.100 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 8 |
| Exact Mass | 224.178 Da |
| Monoisotopic Mass | 224.178 Da |
| Topological Polar Surface Area | 26.300 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 262.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Peng-hua Bai, Jin-Ping Yu, Rui-rui Hu, Qian-wen Fu, Hai-chao Wu, Xing-yue Li, Guo-hao Zu, Bao-sheng Liu, Yu Zhang. (2024) Behavioral and molecular response of the insect parasitic nematode Steinernema carpocapsae to plant volatiles. JOURNAL OF INVERTEBRATE PATHOLOGY, [PMID:38278342] [10.1016/j.jip.2024.108067] |
