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637-07-0

637-07-0 structural image
Product Name: Clofibrate
Formula: C12H15ClO3
Synonyms: 2-(4-Chlorophenoxy)-2-methylpropionic acid ethyl ester;Ethyl 2-(4-chlorophenoxy)-2-methylpropionate;Ethyl 2-(4-chlorophenoxy)isobutyrate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Color/Form OIL
Odor FAINT CHARACTERISTIC ODOR
Taste FAINT CHARACTERISTIC TASTE
Boiling Point 149 °C at 2.00E+01 mm Hg
Melting Point 118-119
Solubility Insoluble
Density 1.138-1.144 @ 20 °C
LogP 3.3
Stability/Shelf Life SENSITIVE TO OXIDATION AND LIGHT; EASILY HYDROLYZED
Refractive Index INDEX OF REFRACTION: 1.500-1.505 @ 19.5-20.5 °C/D; MAX ABSORPTION (DEHYDRATED ETHANOL): 226 NM (A= 910, 1%, 1 CM); 280 NM (A= 87, 1%, 1 CM); 288 NM (A= 62, 1%, 1 CM)
Kovats Retention Index 1535.1 1524 1549 1515 1549

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Corrosion
Corrosives
GHS05

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
H315:Skin corrosion/irritation
H318:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 242.70 g/mol
XLogP3 3.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 242.0709720 g/mol
Monoisotopic Mass 242.0709720 g/mol
Topological Polar Surface Area 35.5 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 232
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Clofibrate is the ethyl ester of clofibric acid. It has a role as an anticholesteremic drug, an antilipemic drug, a geroprotector and a PPARalpha agonist. It is an aromatic ether, a member of monochlorobenzenes and an ethyl ester. It is functionally related to a clofibric acid.