(2E)-3-[4-Hydroxy-2-methoxy-5-(2-methyl-3-buten-2-yl)phenyl]-1-(4-hydroxyphenyl)-2-propen-1-one

Basic Information

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CAS Number

58749-22-7

Molecular Formula

C21H22O4

Molecular Weight

338.4 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Yellow powder

Melting Point

100°

Boiling Point

532.6°C at 760 mmHg

Solubility

Methanol; Ethanol; Acetone; Acetontrile; Ethyl Acetate

SMILES

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CC(C)(C=C)C1=C(C=C(C(=C1)C=CC(=O)C2=CC=C(C=C2)O)OC)O

InChI

InChI=1S/C21H22O4/c1-5-21(2,3)17-12-15(20(25-4)13-19(17)24)8-11-18(23)14-6-9-16(22)10-7-14/h5-13,22,24H,1H2,2-4H3/b11-8+

InChIKey

KAZSKMJFUPEHHW-DHZHZOJOSA-N

LogP

4.466100000000004

Topological Polar Surface Area

66.76 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

488

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H312 Harmful in contact with skin
Acute toxicity, dermal

H332 Harmful if inhaled
Acute toxicity, inhalation

Storage Conditions

2-8℃

Synonyms & References

English

KAZSKMJFUPEHHW-DHZHZOJOSA-N
3-[5-((E)-1,1-Dimethyl-allyl)-4-hydroxy-2-methoxy-phenyl]-1-(4-hydroxy-phenyl)-propenone
JTV5467968
CS-5603
LICOAGROCHACONE A
LICOCHALCONE A [WHO-DD]
UNII-JTV5467968
CCG-208030
Q-100677
Q1644097
(2E)-3-[5-(1,1-dimethyl-2-propen-1-yl)-4-hydroxy-2-methoxyphenyl]-1-(4-hydroxyphenyl)-2-propen-1-one
DTXSID10904181
2-Propen-1-one, 3-[5-(1,1-dimethyl-2-propenyl)-4-hydroxy-2-methoxyphenyl]-1-(4-hydroxyphenyl)- (E)-
87080-27-1
(E)-3-(4-hydroxy-2-methoxy-5-(2-methylbut-3-en-2-yl)phenyl)-1-(4-hydroxyphenyl)prop-2-en-1-one
LicochalconeA
EX-A1193
licochalcone a
(E)-3-[5-(1,1-Dimethyl-allyl)-4-hydroxy-2-methoxy-phenyl]-1-(4-hydroxy-phenyl)-propenone
BDBM50068270
Licochalcone-A
LICOCHALCONE A [MI]
E)-3-[5-(1,1-Dimethyl-2-propenyl)-4-hydroxy-2-methoxyphenyl]-1-(4-hydroxyphenyl)-2-propen-1-one
A902621
58749-22-7
HY-N0372
LMPK12120424
MFCD01417903
SCHEMBL114042
s7828
BRD-K99667445-001-01-4

MDL Number

MFCD01417903

FAQ

What is (2E)-3-[4-Hydroxy-2-methoxy-5-(2-methyl-3-buten-2-yl)phenyl]-1-(4-hydroxyphenyl)-2-propen-1-one (CAS: 58749-22-7)?

This compound, with the CAS number 58749-22-7, is a synthetic organic molecule characterized by its complex structure containing multiple aromatic rings and functional groups. It is known for its potential biological activity and is often studied in the context of natural products and pharmaceutical research due to its structural similarity to certain plant-derived compounds.

What are the main uses of (2E)-3-[4-Hydroxy-2-methoxy-5-(2-methyl-3-buten-2-yl)phenyl]-1-(4-hydroxyphenyl)-2-propen-1-one (CAS: 58749-22-7)?

This compound is primarily used in pharmaceutical research for its potential pharmacological properties. It may also find applications in the development of agrochemicals and as a precursor in the synthesis of other bioactive compounds. Its unique structure makes it relevant for studies in natural product chemistry and drug discovery.

Is (2E)-3-[4-Hydroxy-2-methoxy-5-(2-methyl-3-buten-2-yl)phenyl]-1-(4-hydroxyphenyl)-2-propen-1-one (CAS: 58749-22-7) safe?

Safety of this compound depends on its application and exposure conditions. It is generally considered safe in controlled laboratory settings when handled properly. However, standard safety precautions should be followed, such as wearing personal protective equipment. Long-term toxicity data are limited, so it should be used with caution in industrial or commercial environments.

How should (2E)-3-[4-Hydroxy-2-methoxy-5-(2-methyl-3-buten-2-yl)phenyl]-1-(4-hydroxyphenyl)-2-propen-1-one (CAS: 58749-22-7) be stored?

This compound should be stored in a cool, dry, and well-ventilated area, away from direct light. It is recommended to keep it in a sealed container made of glass or high-density polyethylene (HDPE) to maintain stability. Storage conditions should be maintained at a temperature below 25°C and humidity levels below 60% to prevent degradation.