≥98%(GC)(T) 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 | 488191554 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488191554 |
| Sorrisi canonici | COC(=O)C1=C(C=CC(=C1)O)N |
| IUPAC Name | methyl 2-amino-5-hydroxybenzoate |
| InChIKey | DWBKSTKVIIRFHL-UHFFFAOYSA-N |
| INCHI | 1S/C8H9NO3/c1-12-8(11)6-4-5(10)2-3-7(6)9/h2-4,10H,9H2,1H3 |
| Isomeri SMILES | COC(=O)C1=C(C=CC(=C1)O)N |
| Peso molecolare | 167.16 |
| Reaxy-Rn | 3030742 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3030742&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 | Benzenoids |
| Classe | Benzene and substituted derivatives |
| Subclass | Benzoic acids and derivatives |
| Intermediate Tree Nodes | Benzoic acid esters |
| Direct Parent | m-Hydroxybenzoic acid esters |
| Alternative Parents | Aminobenzoic acids and derivatives p-Aminophenols Benzoyl derivatives Aniline and substituted anilines 1-hydroxy-2-unsubstituted benzenoids Vinylogous amides Methyl esters Amino acids and derivatives Monocarboxylic acids and derivatives Primary amines Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | M-hydroxybenzoic acid ester - Aminobenzoic acid or derivatives - P-aminophenol - Aminophenol - Benzoyl - Aniline or substituted anilines - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Vinylogous amide - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Amine - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound |
| Descrizione | This compound belongs to the class of organic compounds known as m-hydroxybenzoic acid esters. These are benzoic acid esters where the benzene ring is meta-substituted with a hydroxy 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 | Data | Oggetto |
|---|---|---|---|
 G2424388 | Certificate of Analysis | Jun 29, 2024 | M158665 |
| G2424389 | Certificate of Analysis | Jun 29, 2024 | M158665 |
| G2315927 | Certificate of Analysis | Feb 25, 2023 | M158665 |
| G2315942 | Certificate of Analysis | Feb 25, 2023 | M158665 |
| G2315946 | Certificate of Analysis | Feb 25, 2023 | M158665 |
| G2315948 | Certificate of Analysis | Feb 25, 2023 | M158665 |
| G2315949 | Certificate of Analysis | Feb 25, 2023 | M158665 |
| G2315950 | Certificate of Analysis | Feb 25, 2023 | M158665 |
| G2315951 | Certificate of Analysis | Feb 25, 2023 | M158665 |
| G2315952 | Certificate of Analysis | Feb 25, 2023 | M158665 |
| G2315955 | Certificate of Analysis | Feb 25, 2023 | M158665 |
| G2315959 | Certificate of Analysis | Feb 25, 2023 | M158665 |
| J1816085 | Certificate of Analysis | Aug 10, 2022 | M158665 |
| J1816084 | Certificate of Analysis | Aug 08, 2022 | M158665 |
| Solubilità | Slightly soluble in Methanol |
|---|---|
| Punto di fusione (°C) | 158-162℃ |
| Peso molecolare | 167.160 g/mol |
| XLogP3 | 2.300 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 167.058 Da |
| Monoisotopic Mass | 167.058 Da |
| Topological Polar Surface Area | 72.600 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 172.000 |
| 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. Junli Xiao, Jianbo Jin, Shanyi Chen, Jianfeng Zhang, Peijian Cao, Li-Juan Mao, Ran Li. (2024) Methyl benzoate-related compounds as potential repellents and fumigants for the control of cigarette beetle, Lasioderma serricorne (F.). JOURNAL OF STORED PRODUCTS RESEARCH, [PMID:] [10.1016/j.jspr.2024.102276] |
