≥98%(HPLC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads 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 introduction
Aquaporin 1 (AQP1) channel blocker
| Pubchem Sid | 504760163 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504760163 |
| Canonical Smiles | C1=CC(=CC(=C1)C=CC(=O)O)C=CC(=O)O |
| IUPAC Name | (E)-3-[3-[(E)-2-carboxyethenyl]phenyl]prop-2-enoic acid |
| InChIKey | KRXUBZPHAPGHPE-YDFGWWAZSA-N |
| INCHI | 1S/C12H10O4/c13-11(14)6-4-9-2-1-3-10(8-9)5-7-12(15)16/h1-8H,(H,13,14)(H,15,16)/b6-4+,7-5+ |
| Isomeric SMILES | C1=CC(=CC(=C1)/C=C/C(=O)O)/C=C/C(=O)O |
| PubChem CID | 794091 |
| Molecular Weight | 218.211 |
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 | Phenylpropanoids and polyketides |
| Class | Cinnamic acids and derivatives |
| Subclass | Cinnamic acids |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Cinnamic acids |
| Alternative Parents | Styrenes Dicarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Cinnamic acid - Styrene - Benzenoid - Dicarboxylic acid or derivatives - Monocyclic benzene moiety - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as cinnamic acids. These are organic aromatic compounds containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid. |
| 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 |
|---|---|---|---|
 I2222104 | Certificate of Analysis | Jul 10, 2025 | T288661 |
| I2222105 | Certificate of Analysis | Jul 10, 2025 | T288661 |
| I2222106 | Certificate of Analysis | Jul 10, 2025 | T288661 |
| I2222107 | Certificate of Analysis | Jul 10, 2025 | T288661 |
| I2222108 | Certificate of Analysis | Jul 10, 2025 | T288661 |
| Solubility | Solvent:DMSO, Max Conc. mg/mL: 21.82, Max Conc. mM: 100 |
|---|---|
| Molecular Weight | 218.200 g/mol |
| XLogP3 | 2.100 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 218.058 Da |
| Monoisotopic Mass | 218.058 Da |
| Topological Polar Surface Area | 74.600 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 287.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 2 |
| Covalently-Bonded Unit Count | 1 |
