≥98%(GC) 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Pubchem Sid | 488197019 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488197019 |
| Canonical Smiles | COC(=O)C(CC1=CC=CC=C1)O |
| IUPAC Name | methyl (2R)-2-hydroxy-3-phenylpropanoate |
| InChIKey | NMPPJJIBQQCOOI-SECBINFHSA-N |
| INCHI | 1S/C10H12O3/c1-13-10(12)9(11)7-8-5-3-2-4-6-8/h2-6,9,11H,7H2,1H3/t9-/m1/s1 |
| Isomeric SMILES | COC(=O)[C@@H](CC1=CC=CC=C1)O |
| Molecular Weight | 180.2 |
| Reaxy-Rn | 2212291 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2212291&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 esters |
| Alternative Parents | Benzene and substituted derivatives Methyl esters Secondary alcohols Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Fatty acid ester - Benzenoid - Monocyclic benzene moiety - Methyl ester - Secondary alcohol - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as fatty acid esters. These are carboxylic ester derivatives of a fatty acid. |
| 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 |
|---|---|---|---|
 L2212220 | Certificate of Analysis | Jun 09, 2026 | M158823 |
| I2308767 | Certificate of Analysis | Jun 10, 2025 | M158823 |
| I2308768 | Certificate of Analysis | Jun 10, 2025 | M158823 |
| I2308769 | Certificate of Analysis | Jun 10, 2025 | M158823 |
| I2308770 | Certificate of Analysis | Jun 10, 2025 | M158823 |
| I2308771 | Certificate of Analysis | Jun 10, 2025 | M158823 |
| I2308772 | Certificate of Analysis | Jun 10, 2025 | M158823 |
| I2308779 | Certificate of Analysis | Jun 10, 2025 | M158823 |
| I2308783 | Certificate of Analysis | Jun 10, 2025 | M158823 |
| I2308785 | Certificate of Analysis | Jun 10, 2025 | M158823 |
| G1922292 | Certificate of Analysis | Feb 09, 2023 | M158823 |
| Solubility | Soluble in Methanol |
|---|---|
| Specific Rotation[α] | -5° (C=1,MeOH) |
| Boil Point(°C) | 115°C/3mmHg |
| Melt Point(°C) | 49 °C |
| Molecular Weight | 180.200 g/mol |
| XLogP3 | 1.500 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 180.079 Da |
| Monoisotopic Mass | 180.079 Da |
| Topological Polar Surface Area | 46.500 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 162.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| 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 |
