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· · COA & SDS available for every product · Same-day shipping on in-stock items Pseudobaptigenin - Moligand™,≥97% , CAS No.90-29-9
GRADE & PURITY Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥97% Synonyms
3-(Benzo[d][1,3]dioxol-5-yl)-7-hydroxy-4H-chromen-4-one
Storage
Store at 2-8°C,Protected from light,Argon charged
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Why this grade Moligand™,≥97% Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Store at 2-8°C,Protected from light,Argon charged Ships Wet ice Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
3-(Benzo[d][1, 3]dioxol-5-yl)-7-hydroxy-4H-chromen-4-one
Specifications & Purity
Moligand™, ≥97%
Storage
Store at 2-8°C, Protected from light, Argon charged
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Names and Identifiers Canonical Smiles C1OC2=C(O1)C=C(C=C2)C3=COC4=C(C3=O)C=CC(=C4)O IUPAC Name 3-(1,3-benzodioxol-5-yl)-7-hydroxychromen-4-one InChIKey KNJNBKINYHZUGC-UHFFFAOYSA-N INCHI 1S/C16H10O5/c17-10-2-3-11-14(6-10)19-7-12(16(11)18)9-1-4-13-15(5-9)21-8-20-13/h1-7,17H,8H2 Isomeric SMILES C1OC2=C(O1)C=C(C=C2)C3=COC4=C(C3=O)C=CC(=C4)O Alternate CAS 90-29-9 NSC Number 100796 MeSH Entry Terms pseudobaptigenin;psi-baptigenin Molecular Weight 282.25
Documentation 📋 Safety Data Sheet (SDS) Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS → ✅ Certificate of Analysis (COA) Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA → 📊 Datasheet Quick-reference summary of product specifications and applications.
View datasheet → 🔬 Specification Sheet Full quality attributes and acceptance criteria for this grade.
View spec sheet →
Advanced Data Taxonomic Classification Kingdom Organic compounds Superclass Phenylpropanoids and polyketides Class Isoflavonoids Subclass Isoflav-2-enes Intermediate Tree Nodes Not available Direct Parent Isoflavones Alternative Parents Hydroxyisoflavonoids Chromones Benzodioxoles Pyranones and derivatives 1-hydroxy-2-unsubstituted benzenoids Heteroaromatic compounds Oxacyclic compounds Acetals Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic heteropolycyclic compounds Substituents Isoflavone - Hydroxyisoflavonoid - Chromone - Benzopyran - 1-benzopyran - Benzodioxole - Pyranone - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Pyran - Heteroaromatic compound - Oxacycle - Organoheterocyclic compound - Acetal - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound Description This compound belongs to the class of organic compounds known as isoflavones. These are polycyclic compounds containing a 2-isoflavene skeleton which bears a ketone group at the C4 carbon atom. External Descriptors a small molecule Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
3D Structure Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Sensitivity Light sensitive Molecular Weight 282.250 g/mol XLogP3 2.600 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 5 Rotatable Bond Count 1 Exact Mass 282.053 Da Monoisotopic Mass 282.053 Da Topological Polar Surface Area 65.000 Ų Heavy Atom Count 21 Formal Charge 0 Complexity 460.000 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
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