4',5,7-TRIMETHOXYFLAVONE - analytical standard,Moligand™ , CAS No.5631-70-9

CAS: 5631-70-9 Cat. No.: T304003 Summenformel: C18H16O5 Molekulargewicht: 312.32 EG-Nummer: 802-250-3 PubChem CID: 79730
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GRADE & PURITY Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods. Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
Synonyms
4H-1-Benzenopyran-4-one, 5,7-dimethoxy-2-(4-methoxyphenyl)- | 5,7,4'-rimethoxyflavone | A830998 | KBioGR_002516 | 2-(3,4-dimethoxyphenyl)-5-(methylamino)-2-propan-2-ylpentanenitrile | BRD-K68806283-001-02-8 | Oprea1_073610 | Trimethylapogamin | 5,7,4'-Tri
Storage
Room temperature
Shipped In
Normal
★
Size
Deutschland (EU)
USA*
Price
Qty
5mg
T304003-5mg
—
3 Auf Lager
100,57€
20mg
T304003-20mg
—
5 Auf Lager
313,17€
100mg
T304003-100mg
—
5 Auf Lager
689,77€
Enter a quantity for the sizes you want to add.
🧪
Why this grade

analytical standard,Moligand™ Analytischer Standard,Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyme
4H-1-Benzenopyran-4-one, 5,7-dimethoxy-2-(4-methoxyphenyl)- | 5,7,4'-rimethoxyflavone | A830998 | KBioGR_002516 | 2-(3,4-dimethoxyphenyl)-5-(methylamino)-2-propan-2-ylpentanenitrile | BRD-K68806283-001-02-8 | Oprea1_073610 | Trimethylapogamin | 5,7,4'-Tri
Spezifikationen & Reinheit
analytical standard,Moligand™
Biochemische und physiologische Mechanismen
K V 1.5 and K V 11.1 (hERG) channel blocker (IC 50 values are 8 and 30 μM for KV1.5 and hERG respectively). CFTR channel blocker. Putative anti-atrial fibrillation agent. Active in vivo.
Storage
Room temperature
Verschickt in
Normal
Note
Analytischer Standard, Moligand™
Hinweis
Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.
Namen und Kennungen
Pubchem Sid508809125
Kanonisches LächelnCOC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3OC)OC
IUPAC Name5,7-dimethoxy-2-(4-methoxyphenyl)chromen-4-one
InChIKeyZXJJBDHPUHUUHD-UHFFFAOYSA-N
INCHI1S/C18H16O5/c1-20-12-6-4-11(5-7-12)15-10-14(19)18-16(22-3)8-13(21-2)9-17(18)23-15/h4-10H,1-3H3
Isomere SMILES COC1=CC=C(C=C1)C2=CC(=O)C3=C(O2)C=C(C=C3OC)OC
PubChem CID 79730
Molekulargewicht 312.32

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

Taxonomy Tree

KingdomOrganic compounds
SuperclassPhenylpropanoids and polyketides
KlasseFlavonoids
SubclassO-methylated flavonoids
Intermediate Tree Nodes Not available
Direct Parent7-O-methylated flavonoids
Alternative Parents 5-O-methylated flavonoids  4'-O-methylated flavonoids  Flavones  Chromones  Phenoxy compounds  Methoxybenzenes  Anisoles  Pyranones and derivatives  Alkyl aryl ethers  Vinylogous esters  Heteroaromatic compounds  Oxacyclic compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents 4p-methoxyflavonoid-skeleton - 5-methoxyflavonoid-skeleton - 7-methoxyflavonoid-skeleton - Flavone - Chromone - Benzopyran - 1-benzopyran - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Pyranone - Benzenoid - Monocyclic benzene moiety - Pyran - Vinylogous ester - Heteroaromatic compound - Ether - Organoheterocyclic compound - Oxacycle - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
BeschreibungThis compound belongs to the class of organic compounds known as 7-o-methylated flavonoids. These are flavonoids with methoxy groups attached to the C7 atom of the flavonoid backbone.
External Descriptors Flavones and Flavonols
3D-Struktur
Interaktives chemisches Strukturmodell





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Wirkungsmechanismen
Zertifikate (CoA, COO, BSE/TSE und Analyse-Diagramm)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

3 results found

Lot NumberCertificate TypeDatumArtikel
G2108356Certificate of AnalysisMay 17, 2024 T304003
G2108391Certificate of AnalysisMay 17, 2024 T304003
G2108393Certificate of AnalysisMay 17, 2024 T304003
Chemische und physikalische Eigenschaften
Siedepunkt (°C)506.5±50.0℃ at 760 mmHg
Schmelzpunkt (°C)158-160℃
Molekulargewicht312.300 g/mol
XLogP32.200
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass312.1 Da
Monoisotopic Mass312.1 Da
Topological Polar Surface Area54.000 Ų
Heavy Atom Count23
Formal Charge0
Complexity452.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Lösungsrechner
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