≥97% 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.
It may be used as a starting material in the three-step synthesis of dihydro-0-methylsterigmatocystin, a natural mycotoxin.
| Pubchem Sid | 488192887 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488192887 |
| Canonical Smiles | COC1=C(C(=CC=C1)F)C(=O)O |
| IUPAC Name | 2-fluoro-6-methoxybenzoic acid |
| InChIKey | XLNQGZLCGVLNMF-UHFFFAOYSA-N |
| INCHI | 1S/C8H7FO3/c1-12-6-4-2-3-5(9)7(6)8(10)11/h2-4H,1H3,(H,10,11) |
| Isomeric SMILES | COC1=C(C(=CC=C1)F)C(=O)O |
| WGK Germany | 3 |
| Molecular Weight | 170.14 |
| Reaxy-Rn | 4180310 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4180310&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 |
| Class | Benzene and substituted derivatives |
| Subclass | Benzoic acids and derivatives |
| Intermediate Tree Nodes | Methoxybenzoic acids and derivatives |
| Direct Parent | O-methoxybenzoic acids and derivatives |
| Alternative Parents | 2-halobenzoic acids Halobenzoic acids Benzoic acids 1-carboxy-2-haloaromatic compounds Phenoxy compounds Anisoles Methoxybenzenes Benzoyl derivatives Alkyl aryl ethers Fluorobenzenes Aryl fluorides Vinylogous halides Monocarboxylic acids and derivatives Organic oxides Organofluorides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | O-methoxybenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 2-halobenzoic acid - Halobenzoic acid - Benzoic acid - Methoxybenzene - Anisole - 1-carboxy-2-haloaromatic compound - Phenol ether - Benzoyl - Phenoxy compound - Alkyl aryl ether - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Vinylogous halide - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organohalogen compound - Organofluoride - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as o-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 2 of the benzene ring is replaced by a methoxy 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 |
|---|---|---|---|
 D2326575 | Certificate of Analysis | Feb 08, 2025 | F131881 |
| D2326546 | Certificate of Analysis | Feb 07, 2025 | F131881 |
| D2326570 | Certificate of Analysis | Feb 07, 2025 | F131881 |
| D2326573 | Certificate of Analysis | Feb 07, 2025 | F131881 |
| D2326574 | Certificate of Analysis | Feb 07, 2025 | F131881 |
| D2326576 | Certificate of Analysis | Feb 07, 2025 | F131881 |
| D2326577 | Certificate of Analysis | Feb 07, 2025 | F131881 |
| D2326580 | Certificate of Analysis | Feb 07, 2025 | F131881 |
| E2323480 | Certificate of Analysis | May 27, 2023 | F131881 |
| E2323617 | Certificate of Analysis | May 27, 2023 | F131881 |
| E2323620 | Certificate of Analysis | May 27, 2023 | F131881 |
| E2323658 | Certificate of Analysis | May 27, 2023 | F131881 |
| E2323608 | Certificate of Analysis | May 27, 2023 | F131881 |
| E2323622 | Certificate of Analysis | May 27, 2023 | F131881 |
| E2323635 | Certificate of Analysis | May 27, 2023 | F131881 |
| E2323754 | Certificate of Analysis | May 27, 2023 | F131881 |
| Solubility | Soluble in Methanol |
|---|---|
| Melt Point(°C) | 92 °C |
| Molecular Weight | 170.140 g/mol |
| XLogP3 | 0.800 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 170.038 Da |
| Monoisotopic Mass | 170.038 Da |
| Topological Polar Surface Area | 46.500 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 |
