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≥98% 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.
| Pubchem Sid | 504756757 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504756757 |
| Canonical Smiles | CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC6=CC=CC=C65 |
| IUPAC Name | 9'-(diethylamino)spiro[2-benzofuran-3,12'-benzo[a]xanthene]-1-one |
| InChIKey | HMNGPLGXLQFPFN-UHFFFAOYSA-N |
| INCHI | 1S/C28H23NO3/c1-3-29(4-2)19-14-15-23-25(17-19)31-24-16-13-18-9-5-6-10-20(18)26(24)28(23)22-12-8-7-11-21(22)27(30)32-28/h5-17H,3-4H2,1-2H3 |
| Isomeric SMILES | CCN(CC)C1=CC2=C(C=C1)C3(C4=CC=CC=C4C(=O)O3)C5=C(O2)C=CC6=CC=CC=C65 |
| Molecular Weight | 421.5 |
| Reaxy-Rn | 56364 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=56364&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 | Organoheterocyclic compounds |
| Class | Benzopyrans |
| Subclass | 1-benzopyrans |
| Intermediate Tree Nodes | Dibenzopyrans - Xanthenes |
| Direct Parent | Benzoxanthenes |
| Alternative Parents | Isoflavonoids Naphthopyrans Diarylethers Phthalides Benzofuranones Naphthalenes Isobenzofurans Dialkylarylamines Pyrans Amino acids and derivatives Carboxylic acid esters Lactones Monocarboxylic acids and derivatives Oxacyclic compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Benzoxanthene - Isoflavonoid - Naphthopyran - Diaryl ether - Benzofuranone - Naphthalene - Isobenzofuranone - Phthalide - Isocoumaran - Isobenzofuran - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Pyran - Benzenoid - Tertiary amine - Amino acid or derivatives - Lactone - Carboxylic acid ester - Carboxylic acid derivative - Ether - Oxacycle - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Organopnictogen compound - Amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as benzoxanthenes. These are organic compounds containing a benzene ring fused to a xanthene ring system. Xanthene is a tricyclic compound made up of two benzene rings linearly fused to each other through a pyran 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 | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Jun 17, 2024 | D154711 | |
| Certificate of Analysis | Jun 17, 2024 | D154711 | |
| Certificate of Analysis | Mar 12, 2024 | D154711 | |
| Certificate of Analysis | Mar 12, 2024 | D154711 | |
| Certificate of Analysis | May 31, 2023 | D154711 | |
| Certificate of Analysis | May 31, 2023 | D154711 | |
| Certificate of Analysis | May 31, 2023 | D154711 |
| Melt Point(°C) | 221 °C |
|---|---|
| Molecular Weight | 421.500 g/mol |
| XLogP3 | 6.200 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 421.168 Da |
| Monoisotopic Mass | 421.168 Da |
| Topological Polar Surface Area | 38.800 Ų |
| Heavy Atom Count | 32 |
| Formal Charge | 0 |
| Complexity | 707.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |