5-Methyl-7-methoxyisoflavone - 10mM in DMSO , CAS No.82517-12-2

CAS: 82517-12-2 Cat. No.: M426133 Molecular Weight: 266.29
AVAILABLE TO ORDER
GRADE & PURITY 10mM in DMSO
Synonyms
Q1176343 | 7-methoxy-5-methyl-3-phenylchromen-4-one | DTXSID201002754 | CCG-267106 | AS-66221 | UNII-NHW23TRU3M | 5-Methyl-7-methoxyisoflavone | 5-methyl-7-methoxy-isoflavone | AC-12239 | F17690 | NHW23TRU3M | HY-N1993 | M3190 | AC-34340 | MFCD03093036 |
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1ml
M426133-1ml
1

$50.90

$69.90
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Why this grade

10mM in DMSO for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at -80°C Ships Dry ice packs + Cold packs 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
Q1176343 | 7-methoxy-5-methyl-3-phenylchromen-4-one | DTXSID201002754 | CCG-267106 | AS-66221 | UNII-NHW23TRU3M | 5-Methyl-7-methoxyisoflavone | 5-methyl-7-methoxy-isoflavone | AC-12239 | F17690 | NHW23TRU3M | HY-N1993 | M3190 | AC-34340 | MFCD03093036 |
Specifications & Purity
10mM in DMSO
Storage
Store at -80°C
Shipped In
Dry ice packs + Cold packs
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type
INHIBITOR
Names and Identifiers
Canonical SmilesCC1=CC(=CC2=C1C(=O)C(=CO2)C3=CC=CC=C3)OC
IUPAC Name7-methoxy-5-methyl-3-phenylchromen-4-one
InChIKeyWGOUYULOZZRTFS-UHFFFAOYSA-N
INCHI1S/C17H14O3/c1-11-8-13(19-2)9-15-16(11)17(18)14(10-20-15)12-6-4-3-5-7-12/h3-10H,1-2H3
Isomeric SMILES CC1=CC(=CC2=C1C(=O)C(=CO2)C3=CC=CC=C3)OC
Molecular Weight 266.29
Reaxy-Rn 4873024
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4873024&ln=

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.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 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
ClassIsoflavonoids
SubclassO-methylated isoflavonoids
Intermediate Tree Nodes 7-O-methylated isoflavonoids
Direct Parent7-O-methylisoflavones
Alternative Parents Isoflavones  Chromones  Anisoles  Pyranones and derivatives  Alkyl aryl ethers  Benzene and substituted derivatives  Heteroaromatic compounds  Oxacyclic compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents 7-o-methylisoflavone - Isoflavone - Chromone - Benzopyran - 1-benzopyran - Anisole - Alkyl aryl ether - Pyranone - Pyran - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Oxacycle - Ether - Organoheterocyclic compound - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as 7-o-methylisoflavones. These are isoflavones with methoxy groups attached to the C7 atom of the isoflavone backbone.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Melt Point(°C)117-121° C
Molecular Weight266.290 g/mol
XLogP33.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass266.094 Da
Monoisotopic Mass266.094 Da
Topological Polar Surface Area35.500 Ų
Heavy Atom Count20
Formal Charge0
Complexity395.000
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
Solution Calculators
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