Isopropyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate

Basic Information

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CAS Number

49562-28-9

Molecular Formula

C20H21ClO4

Molecular Weight

360.84 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 Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

79.0 to 83.0 deg-C

Boiling Point

469.8 °C at 760 mmHg

Density

1.177

Flash Point

165.4 °C

SMILES

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CC(C)OC(=O)C(C)(C)OC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H21ClO4/c1-13(2)24-19(23)20(3,4)25-17-11-7-15(8-12-17)18(22)14-5-9-16(21)10-6-14/h5-13H,1-4H3

InChIKey

YMTINGFKWWXKFG-UHFFFAOYSA-N

LogP

4.680000000000004

Topological Polar Surface Area

52.6 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

458

Safety Information

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Hazard Statement

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

Toxicity

LD50 in mice: 1600 mg/kg orally (Sornay)

Synonyms & References

English

Prestwick_217
A827746
Procetoken
Lofibra
Fenomax
Lopac-F-6020
NCGC00021475-03
Fenobrate
FENOFIBRATE [MI]
FENOFIBRATE [USAN]
Fenofibrate, >=99%, powder
2-[4-(4-Chlorobenzoyl)phenoxy]-2-methylpropanoic acid 1-methylethyl ester
Lipofen
HMS2090G20
Lipirex
FENOFIBRATE (EP MONOGRAPH)
Tox21_500486
Fenofibrate,(S)
Liposit
Lipoclar
Isopropyl (4'-(p-chlorobenzoyl)-2-phenoxy-2-methyl)propionate
Lipofen (TN)
49562-28-9
NSC-757822
Propanoic acid, 2-[4-(4-chlorobenzoyl)phenoxy]-2-methyl-, 1-methylethyl ester
EU-0100486
AB03716
FENOFIBRATE [EMA EPAR]
HY-17356R
Lipidax
isopropyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate

MDL Number

MFCD00133314

Customs Code

2932999099

FAQ

What is Isopropyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate (CAS: 49562-28-9)?

Isopropyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate (CAS: 49562-28-9) is an organic ester compound with the chemical formula C19H22ClO4. It features a benzoyl group substituted with a 4-chlorophenoxy moiety, attached to an isopropyl and 2-methylpropanoate chain. The compound is typically a white crystalline solid with low solubility in water and moderate solubility in organic solvents. It is used as an intermediate in chemical synthesis and exhibits stability under standard conditions.

What are the main uses of Isopropyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate (CAS: 49562-28-9)?

Isopropyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate (CAS: 49562-28-9) is primarily used in pharmaceutical research as a precursor for developing drugs targeting inflammatory diseases. It also serves in agrochemical formulations for pest control and in industrial applications for polymer synthesis. Its unique structure makes it valuable for creating derivatives with specific biological activities, particularly in the chemical and pharmaceutical industries.

Is Isopropyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate (CAS: 49562-28-9) safe?

Isopropyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate (CAS: 49562-28-9) requires careful handling due to its potential toxicity. Inhalation or skin contact may cause irritation, and it should be used in well-ventilated areas with appropriate protective equipment. Safety standards emphasize adherence to OSHA and EPA guidelines for chemical exposure. Always follow safety protocols to minimize risks during use or storage.

How should Isopropyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate (CAS: 49562-28-9) be stored?

Isopropyl 2-[4-(4-chlorobenzoyl)phenoxy]-2-methylpropanoate (CAS: 49562-28-9) should be stored in a cool, dry place (ideally 2-8°C), away from light and moisture. Keep it in a sealed, airtight container made of inert material like glass or polyethylene to maintain stability. Avoid exposure to heat or humidity to prevent degradation, and ensure proper labeling for safe handling and storage.