≥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.
Product Description
N,N'-Dibenzoyl-L-cystine chiral modifier of LiBH4 for enantioselective reductions of heteroaromatic , aromatic, and unsaturated ketones to alcohols.
Product Application
Reactant involved in:
Synthesis of integrin antagonists
Dissipative self-assembly of molecular gelator using chemical fuel
Synthesis of crosslinkable hydrogel for proliferation of encapsulated human derm fibroblast
Analysis for use as metallo-β-lactamase inhibitors
Amplification of bifunctional disulfide ligands for calmodulin
| Pubchem Sid | 504767417 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504767417 |
| Sonrisas canónicas | C1=CC=C(C=C1)C(=O)NC(CSSCC(C(=O)O)NC(=O)C2=CC=CC=C2)C(=O)O |
| IUPAC Name | (2R)-2-benzamido-3-[[(2R)-2-benzamido-2-carboxyethyl]disulfanyl]propanoic acid |
| InChIKey | GUTXMPQWQSOAIY-HOTGVXAUSA-N |
| INCHI | 1S/C20H20N2O6S2/c23-17(13-7-3-1-4-8-13)21-15(19(25)26)11-29-30-12-16(20(27)28)22-18(24)14-9-5-2-6-10-14/h1-10,15-16H,11-12H2,(H,21,23)(H,22,24)(H,25,26)(H,27,28)/t15-,16-/m0/s1 |
| Isómeros SMILES | C1=CC=C(C=C1)C(=O)N[C@@H](CSSC[C@@H](C(=O)O)NC(=O)C2=CC=CC=C2)C(=O)O |
| Peso molecular | 448.51 |
| Reaxy-Rn | 2068209 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2068209&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 |
| Clase | Benzene and substituted derivatives |
| Subclass | Benzoic acids and derivatives |
| Intermediate Tree Nodes | Benzamides - Hippuric acids and derivatives |
| Direct Parent | Hippuric acids |
| Alternative Parents | N-acyl-alpha amino acids Cysteine and derivatives Benzoyl derivatives Dicarboxylic acids and derivatives Secondary carboxylic acid amides Dialkyldisulfides Sulfenyl compounds Carboxylic acids Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Hippuric acid - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Cysteine or derivatives - Alpha-amino acid or derivatives - Benzoyl - Dicarboxylic acid or derivatives - Carboxamide group - Dialkyldisulfide - Secondary carboxylic acid amide - Organic disulfide - Carboxylic acid derivative - Carboxylic acid - Sulfenyl compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Carbonyl group - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Aromatic homomonocyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as hippuric acids. These are compounds containing hippuric acid, which consists of a of a benzoyl group linked to the N-terminal of a glycine. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
 F2215042 | Certificate of Analysis | Mar 04, 2025 | N351952 |
| F2215043 | Certificate of Analysis | Mar 04, 2025 | N351952 |
| F2215047 | Certificate of Analysis | Mar 04, 2025 | N351952 |
| L2431026 | Certificate of Analysis | May 23, 2022 | N351952 |
| Sensibilidad | Moisture sensitive |
|---|---|
| Rotación específica [α] | [α]20/D −215±8°, c = 1% in ethanol |
| Punto de fusión (°C) | 195-200 °C (dec.) |
| Peso molecular | 448.500 g/mol |
| XLogP3 | 2.100 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 8 |
| Rotatable Bond Count | 11 |
| Exact Mass | 448.076 Da |
| Monoisotopic Mass | 448.076 Da |
| Topological Polar Surface Area | 183.000 Ų |
| Heavy Atom Count | 30 |
| Formal Charge | 0 |
| Complexity | 554.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 2 |
| 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 |
