Determine the necessary mass, volume, or concentration for preparing a solution.
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| SKU | Size | Availability |
Price | Qty |
|---|---|---|---|---|
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D154918-1g
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1g |
Available within 4-8 weeks(?)
Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!
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$9.90
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D154918-5g
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5g |
Available within 4-8 weeks(?)
Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!
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$15.90
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D154918-25g
|
25g |
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
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$26.90
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| Synonyms | D89795 | (2.5-dichloro-phenylsulfanyl)-acetic acid | 2-06-00-00299 (Beilstein Handbook Reference) | Acetic acid,5-dichlorophenyl)thio]- | TS-03324 | 2,5-Dichlorophenylthioglycolic acid | D1146 | NSC36971 | NSC-36971 | NSC 36971 | 2-(2,5-dichlorophenyl)sul |
|---|---|
| Specifications & Purity | ≥98%(GC)(T) |
| Shipped In | Normal |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Halobenzenes |
| Intermediate Tree Nodes | Chlorobenzenes |
| Direct Parent | Dichlorobenzenes |
| Alternative Parents | Thiophenol ethers Alkylarylthioethers Aryl chlorides Sulfenyl compounds Monocarboxylic acids and derivatives Carboxylic acids Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Aryl thioether - 1,4-dichlorobenzene - Thiophenol ether - Alkylarylthioether - Aryl chloride - Aryl halide - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Thioether - Sulfenyl compound - Organohalogen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organochloride - Organooxygen compound - Organosulfur compound - Carbonyl group - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it. |
| External Descriptors | Not available |
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| IUPAC Name | 2-(2,5-dichlorophenyl)sulfanylacetic acid |
|---|---|
| INCHI | InChI=1S/C8H6Cl2O2S/c9-5-1-2-6(10)7(3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12) |
| InChIKey | DCXXCTCEJFBLPD-UHFFFAOYSA-N |
| Smiles | C1=CC(=C(C=C1Cl)SCC(=O)O)Cl |
| Isomeric SMILES | C1=CC(=C(C=C1Cl)SCC(=O)O)Cl |
| RTECS | AG9041000 |
| Molecular Weight | 237.09 |
| Reaxy-Rn | 1969006 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1969006&ln= |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Jun 09, 2025 | D154918 |
| Solubility | Soluble in Alcohol |
|---|---|
| Melt Point(°C) | 129 °C |
| Molecular Weight | 237.100 g/mol |
| XLogP3 | 3.300 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 235.947 Da |
| Monoisotopic Mass | 235.947 Da |
| Topological Polar Surface Area | 62.600 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 189.000 |
| 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 |