≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C,Argon charged Ships Wet ice 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 508809661 |
|---|---|
| Canonical Smiles | CC(C)CCC(=O)OC |
| IUPAC Name | methyl 4-methylpentanoate |
| InChIKey | KBCOVKHULBZKNY-UHFFFAOYSA-N |
| INCHI | 1S/C7H14O2/c1-6(2)4-5-7(8)9-3/h6H,4-5H2,1-3H3 |
| Isomeric SMILES | CC(C)CCC(=O)OC |
| Molecular Weight | 130.18 |
| Reaxy-Rn | 1744681 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1744681&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 | Fatty Acyls |
| Subclass | Fatty acid esters |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Fatty acid methyl esters |
| Alternative Parents | Methyl esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Fatty acid methyl ester - Methyl ester - 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 fatty acid methyl esters. These are compounds containing a fatty acid that is esterified with a methyl group. They have the general structure RC(=O)OR', where R=fatty aliphatic tail or organyl group and R'=methyl group. |
| 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 |
|---|---|---|---|
 A2623684 | Certificate of Analysis | Dec 19, 2025 | M464241 |
| A2623685 | Certificate of Analysis | Dec 19, 2025 | M464241 |
| A2422084 | Certificate of Analysis | Dec 22, 2023 | M464241 |
| A2422085 | Certificate of Analysis | Dec 22, 2023 | M464241 |
| A2422086 | Certificate of Analysis | Dec 22, 2023 | M464241 |
| A2422087 | Certificate of Analysis | Dec 22, 2023 | M464241 |
| A2422088 | Certificate of Analysis | Dec 22, 2023 | M464241 |
| A2422089 | Certificate of Analysis | Dec 22, 2023 | M464241 |
| A2422090 | Certificate of Analysis | Dec 22, 2023 | M464241 |
| H2514091 | Certificate of Analysis | Dec 22, 2023 | M464241 |
| K2506100 | Certificate of Analysis | Dec 22, 2023 | M464241 |
| Refractive Index | n20/D 1.404 (lit.) |
|---|---|
| Boil Point(°C) | 139-140 °C (lit.) |
| Molecular Weight | 130.180 g/mol |
| XLogP3 | 2.100 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 130.099 Da |
| Monoisotopic Mass | 130.099 Da |
| Topological Polar Surface Area | 26.300 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 86.900 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
