≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at 2-8°C 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 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 504754895 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504754895 |
| Canonical Smiles | CC(C)(C(=O)OC)O |
| IUPAC Name | methyl 2-hydroxy-2-methylpropanoate |
| InChIKey | XYVQFUJDGOBPQI-UHFFFAOYSA-N |
| INCHI | 1S/C5H10O3/c1-5(2,7)4(6)8-3/h7H,1-3H3 |
| Isomeric SMILES | CC(C)(C(=O)OC)O |
| WGK Germany | 3 |
| UN Number | 1993 |
| Molecular Weight | 118.13 |
| Beilstein | 1746607 |
| Reaxy-Rn | 1746607 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1746607&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 | Organic oxygen compounds |
| Class | Organooxygen compounds |
| Subclass | Alcohols and polyols |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Tertiary alcohols |
| Alternative Parents | Methyl esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Methyl ester - Tertiary alcohol - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxide - Hydrocarbon derivative - Carbonyl group - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as tertiary alcohols. These are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ). |
| 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 |
|---|---|---|---|
 G2209272 | Certificate of Analysis | Apr 07, 2026 | M100572 |
| G2209273 | Certificate of Analysis | Apr 07, 2026 | M100572 |
| K2110612 | Certificate of Analysis | Aug 19, 2025 | M100572 |
| K2110613 | Certificate of Analysis | Aug 19, 2025 | M100572 |
| E2421523 | Certificate of Analysis | May 08, 2024 | M100572 |
| E2421544 | Certificate of Analysis | May 08, 2024 | M100572 |
| H2323368 | Certificate of Analysis | Aug 08, 2023 | M100572 |
| H2323369 | Certificate of Analysis | Aug 08, 2023 | M100572 |
| H2323506 | Certificate of Analysis | Aug 08, 2023 | M100572 |
| H2323589 | Certificate of Analysis | Aug 08, 2023 | M100572 |
| H2323590 | Certificate of Analysis | Aug 08, 2023 | M100572 |
| J1914072 | Certificate of Analysis | Jul 31, 2023 | M100572 |
| G2209271 | Certificate of Analysis | Jul 04, 2022 | M100572 |
| Refractive Index | 1.411 |
|---|---|
| Flash Point(°F) | 107.6 °F |
| Flash Point(°C) | 41℃ |
| Boil Point(°C) | 137°C |
| Molecular Weight | 118.130 g/mol |
| XLogP3 | 0.100 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 118.063 Da |
| Monoisotopic Mass | 118.063 Da |
| Topological Polar Surface Area | 46.500 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 95.800 |
| 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 |
| 1. Chaonan Tao, Lincai Peng, Junhua Zhang, Liang He. (2020) Al-modified heteropolyacid facilitates alkyl levulinate production from cellulose and lignocellulosic biomass: Kinetics and mechanism studies. FUEL PROCESSING TECHNOLOGY, [PMID:] [10.1016/j.fuproc.2020.106709] |
