≥95% 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.
| Sonrisas canónicas | COC1=CC(=C(C=C1C(=O)O)Cl)N2C(=O)C3=CC=CC=C3C2=O |
|---|---|
| IUPAC Name | 5-chloro-4-(1,3-dioxoisoindol-2-yl)-2-methoxybenzoic acid |
| InChIKey | SSWJZDOVLMABNH-UHFFFAOYSA-N |
| INCHI | 1S/C16H10ClNO5/c1-23-13-7-12(11(17)6-10(13)16(21)22)18-14(19)8-4-2-3-5-9(8)15(18)20/h2-7H,1H3,(H,21,22) |
| Peso molecular | 331.7 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Clase | 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 | Phthalimides 3-halobenzoic acids Halobenzoic acids Benzoic acids Isoindoles Methoxyanilines Methoxybenzenes Anisoles Benzoyl derivatives Phenoxy compounds Alkyl aryl ethers Chlorobenzenes N-substituted carboxylic acid imides Aryl chlorides Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organopnictogen compounds Organic oxides Organochlorides Organonitrogen compounds |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | O-methoxybenzoic acid or derivatives - Phthalimide - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 3-halobenzoic acid - Isoindolone - Halobenzoic acid - Benzoic acid - Isoindoline - Isoindole - Isoindole or derivatives - Methoxyaniline - Methoxybenzene - Benzoyl - Phenoxy compound - Phenol ether - Anisole - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Carboxylic acid imide, n-substituted - Aryl halide - Carboxylic acid imide - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Ether - Carboxylic acid - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound |
| Descripción | 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 |
| Peso molecular | 331.700 g/mol |
|---|---|
| XLogP3 | 2.600 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 331.025 Da |
| Monoisotopic Mass | 331.025 Da |
| Topological Polar Surface Area | 83.900 Ų |
| Heavy Atom Count | 23 |
| Formal Charge | 0 |
| Complexity | 501.000 |
| 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 |
