≥98% 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.
antihypertensives, contraceptives, peripheral vasodilators, and drugs in the treatment of parkinsonism
| ALogP | 1.383 |
|---|---|
| Contagem HBD | 1 |
| Ligação rotativa | 2 |
| Pubchem Sid | 528768407 |
|---|---|
| Sorrisos canónicos | C1COC2=C1C=C(C=C2)CN3CCNCC3 |
| IUPAC Name | 1-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazine |
| InChIKey | WVVYETFQVXIRRZ-UHFFFAOYSA-N |
| INCHI | 1S/C13H18N2O/c1-2-13-12(3-8-16-13)9-11(1)10-15-6-4-14-5-7-15/h1-2,9,14H,3-8,10H2 |
| SMILES isoméricas | C1COC2=C1C=C(C=C2)CN3CCNCC3 |
| PubChem CID | 6453245 |
| Peso molecular | 218.29 |
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 | Organoheterocyclic compounds |
| Classe | Coumarans |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Coumarans |
| Alternative Parents | N-alkylpiperazines Aralkylamines Alkyl aryl ethers Benzenoids Trialkylamines Oxacyclic compounds Dialkylamines Azacyclic compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Coumaran - Alkyl aryl ether - Aralkylamine - N-alkylpiperazine - 1,4-diazinane - Piperazine - Benzenoid - Tertiary amine - Tertiary aliphatic amine - Secondary aliphatic amine - Ether - Secondary amine - Oxacycle - Azacycle - Organonitrogen compound - Amine - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound |
| Descrição | This compound belongs to the class of organic compounds known as coumarans. These are compounds containing the coumaran skeleton, which consists of a benzene ring fused to a 2,3-dihydrofuran ring. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Data | Item |
|---|---|---|---|
 C2625092 | Certificate of Analysis | Apr 06, 2026 | W417907 |
| D2308547 | Certificate of Analysis | Jan 20, 2026 | W417907 |
| D2308549 | Certificate of Analysis | Jan 20, 2026 | W417907 |
| D2308550 | Certificate of Analysis | Jan 20, 2026 | W417907 |
| D2308551 | Certificate of Analysis | Jan 20, 2026 | W417907 |
| DMSO (mM) Solubilidade máxima | 10 |
|---|---|
| Peso molecular | 218.290 g/mol |
| XLogP3 | 1.100 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 218.142 Da |
| Monoisotopic Mass | 218.142 Da |
| Topological Polar Surface Area | 24.500 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 228.000 |
| 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 |
