7-Methoxy-5-methyl-3-phenyl-4H-chromen-4-one

Basic Information

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CAS Number

82517-12-2

Molecular Formula

C17H14O3

Molecular Weight

266.3 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Powder

Melting Point

118.0 to 122.0 deg-C

Boiling Point

449.3 ℃ at 760 mmHg

Density

1.2327 (rough estimate)

Refractive Index

1.4500 (estimate)

SMILES

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CC1=CC(=CC2=C1C(=O)C(=CO2)C3=CC=CC=C3)OC

InChI

InChI=1S/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

InChIKey

WGOUYULOZZRTFS-UHFFFAOYSA-N

LogP

3.777020000000003

Topological Polar Surface Area

39.44 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

395

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

AC-34340
7-Methoxy-5-methyl-3-phenyl-4H-chromen-4-one
AMY15296
CCG-267106
Q1176343
5-Methyl-7-methoxyisoflavone
F17690
5-Methyl 7-methoxyisoflavone
A840364
AC-12239
NHW23TRU3M
WGOUYULOZZRTFS-UHFFFAOYSA-N
CHEMBL1269598
SCHEMBL1227819
S9139
AS-66221
FT-0620640
DTXSID201002754
5-Methyl-7-Methoxy -Isoflavone
HY-N1993
M3190
MFCD03093036
AKOS015918394
82517-12-2
CS-0018314
7-methoxy-5-methyl-3-phenylchromen-4-one
5-methyl-7-methoxy-isoflavone
4H-1-Benzopyran-4-one, 7-methoxy-5-methyl-3-phenyl-
7-METHOXY-5-METHYLISOFLAVONE
UNII-NHW23TRU3M
5-methyl-7-methoxy-Isoflavone

MDL Number

MFCD03093036

Customs Code

2932999099

FAQ

What is 7-Methoxy-5-methyl-3-phenyl-4H-chromen-4-one (CAS: 82517-12-2)?

7-Methoxy-5-methyl-3-phenyl-4H-chromen-4-one (CAS: 82517-12-2) is a chromen-4-one derivative with a molecular formula of C15H12O3. It exhibits moderate solubility in organic solvents and is characterized by its conjugated aromatic ring system, functional groups including a methoxy (-OCH3) and methyl (-CH3) substituents, and a ketone group. This compound is commonly used as a research chemical in synthetic organic chemistry.

What are the main uses of 7-Methoxy-5-methyl-3-phenyl-4H-chromen-4-one (CAS: 82517-12-2)?

7-Methoxy-5-methyl-3-phenyl-4H-chromen-4-one (CAS: 82517-12-2) is primarily utilized in pharmaceutical research as a potential drug intermediate. It may also serve in agrochemicals and materials science for developing new compounds. Its unique chemical structure makes it valuable in the synthesis of bioactive molecules and as a building block for further functionalization in laboratory settings.

Is 7-Methoxy-5-methyl-3-phenyl-4H-chromen-4-one (CAS: 82517-12-2) safe?

7-Methoxy-5-methyl-3-phenyl-4H-chromen-4-one (CAS: 82517-12-2) is generally considered safe when handled properly. However, as a chemical compound, it requires standard safety precautions such as wearing gloves, goggles, and a lab coat. Inhalation and ingestion should be avoided. It is important to follow OSHA guidelines and proper disposal protocols to ensure workplace safety.

How should 7-Methoxy-5-methyl-3-phenyl-4H-chromen-4-one (CAS: 82517-12-2) be stored?

7-Methoxy-5-methyl-3-phenyl-4H-chromen-4-one (CAS: 82517-12-2) should be stored in a cool, dry place (ideally 2-8°C), protected from light. Use airtight containers to prevent moisture absorption and contamination. Ensure storage areas are well-ventilated and keep the compound away from incompatible materials to maintain stability and safety.