CAS No.52214-84-3,Ciprofibrate Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	52214-84-3
Name:	Ciprofibrate
Article Data:	13

Formula:	C₁₃H₁₄Cl₂O₃
Molecular Weight:	289.158
Synonyms:	2-[p-(2,2-Dichlorocyclopropyl)phenoxy]-2-methylpropionic acid;Propanoicacid, 2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methyl-;Ciprol;Lipanor;Modalim;Win 35833;
EINECS:	257-744-6
Density:	1.37 g/cm³
Melting Point:	114 - 118oC
Boiling Point:	424.9 °C at 760 mmHg
Flash Point:	210.7 °C
Appearance:	White or almost white powder
Hazard Symbols:	T
Risk Codes:	45
Safety:	53-22-36/37/39-45
PSA:	46.53000
LogP:	3.58980

Synthetic route

: 130232-51-8, 130233-23-7, 130233-24-8
methyl 2-(4-(2,2-dichlorocyclopropyl)phenoxy)-2-methylpropanoate

: 52214-84-3
2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoic acid

Conditions

Conditions	Yield
With sodium hydroxide In ethanol at 20℃; for 0.5h;	92%
With sodium hydroxide In ethanol; water at 20℃; for 0.5h; pH=3 - 4; Solvent; Large scale;	91%

: 52179-28-9, 144940-19-2, 144940-25-0
ethyl 2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropionate

: 52214-84-3
2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoic acid

Conditions

Conditions	Yield
With sodium hydroxide In methanol; water at 20℃; for 0.5h;	90%

: 52179-26-7, 135133-52-7, 135133-54-9
(-)-4-(2,2-dichlorocyclopropyl)phenol

: 52214-84-3
2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoic acid

Conditions

Conditions	Yield
With sodium hydroxide In chloroform; acetone
With sodium hydroxide

: 2628-17-3
4-Vinylphenol

: 52214-84-3
2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoic acid

Conditions

Conditions	Yield
Multi-step reaction with 3 steps 1: potassium carbonate / acetonitrile / 48 h / 20 °C 2: trimethyldodecylammonium chloride; sodium hydroxide / 24 h / 20 °C 3: sodium hydroxide / methanol; water / 0.5 h / 20 °C View Scheme
Multi-step reaction with 3 steps 1: caesium carbonate / acetonitrile / 24 h / 20 °C 2: sodium hydroxide; tetrabutylammomium bromide / 12 h / 0 - 20 °C 3: sodium hydroxide / ethanol / 0.5 h / 20 °C View Scheme
Multi-step reaction with 3 steps 1: caesium carbonate / acetonitrile / 12 h / 20 °C 2: sodium hydroxide; tetrabutylammomium bromide / chloroform / 12 h / 0 - 20 °C / Autoclave; Large scale 3: sodium hydroxide / ethanol; water / 0.5 h / 20 °C / pH 3 - 4 / Large scale View Scheme

: 7400-08-0
p-Coumaric Acid

: 52214-84-3
2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoic acid

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1: potassium acetate / N,N-dimethyl-formamide / 150 °C 2: caesium carbonate / acetonitrile / 24 h / 20 °C 3: sodium hydroxide; tetrabutylammomium bromide / 12 h / 0 - 20 °C 4: sodium hydroxide / ethanol / 0.5 h / 20 °C View Scheme
Multi-step reaction with 4 steps 1: potassium acetate / N,N-dimethyl-formamide / 150 °C 2: potassium carbonate / acetonitrile / 48 h / 20 °C 3: trimethyldodecylammonium chloride; sodium hydroxide / 24 h / 20 °C 4: sodium hydroxide / methanol; water / 0.5 h / 20 °C View Scheme

: C13H16O3

: 52214-84-3
2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoic acid

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: sodium hydroxide; tetrabutylammomium bromide / 12 h / 0 - 20 °C 2: sodium hydroxide / ethanol / 0.5 h / 20 °C View Scheme

: 123-08-0
4-hydroxy-benzaldehyde

: 52214-84-3
2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoic acid

Conditions

Conditions	Yield
Multi-step reaction with 4 steps 1: ethylenediamine / N,N-dimethyl-formamide / 6 h / 150 °C / Large scale 2: caesium carbonate / acetonitrile / 12 h / 20 °C 3: sodium hydroxide; tetrabutylammomium bromide / chloroform / 12 h / 0 - 20 °C / Autoclave; Large scale 4: sodium hydroxide / ethanol; water / 0.5 h / 20 °C / pH 3 - 4 / Large scale View Scheme
Multi-step reaction with 3 steps 1: diethylamine / toluene / 2 h / 150 °C / Green chemistry 2: sodium hydroxide; tetrabutylammomium bromide / 40 °C / Green chemistry 3: magnesium; titanium tetrachloride / dichloromethane; tetrahydrofuran / 2 h / 0 - 120 °C / Green chemistry View Scheme

: 56-23-5
tetrachloromethane

: 2-methyl-2-(4-vinylphenoxy)propionic acid

: 52214-84-3
2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoic acid

Conditions

Conditions	Yield
With titanium tetrachloride; magnesium In tetrahydrofuran; dichloromethane at 0 - 120℃; for 2h; Green chemistry;	98.6 %Chromat.

: 84443-44-7
bromoethyl isobutyrate

: 4-(2,2-dichlorocyclopropyl)phenyl acetate

: 52214-84-3
2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoic acid

Conditions

Conditions	Yield
Stage #1: 4-(2,2-dichlorocyclopropyl)phenyl acetate With potassium carbonate In methanol at 20℃; for 10h; Stage #2: bromoethyl isobutyrate In methanol for 24h; Reflux; Stage #3: With water Temperature; Alkaline conditions;	240 g

: 52214-84-3
2-[4-(2,2-dichlorocyclopropyl)phenoxy]-2-methylpropanoic acid

: 7524-50-7
methyl (2S)-2-amino-3-phenylpropanoate hydrochloride

: 538-75-0
dicyclohexyl-carbodiimide

A: (2S)-2-({2-[4-(2,2-Dichlorcyclopropyl)phenoxy]-2-methylpropanoyl}amino)-3-phenylpropansaeure-methylester

B: N-Cyclohexyl-N-(cyclohexylcarbamoyl)-2-[4-(2,2-dichlorcyclopropyl)phenoxy]-2-methylpropanamid

Conditions

Conditions	Yield
With dmap; triethylamine In dichloromethane at 20℃; for 20h;	A 95% B n/a

...Expand

Raw Materials

52179-26-7

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Chemistry

The molecular structure of Ciprofibrate (CAS NO.52214-84-3):

IUPAC Name: 2-[4-(2,2-Dichlorocyclopropyl)phenoxy]-2-methylpropanoic acid
Molecular Weight: 289.15446 g/mol
Molecular Formula: C₁₃H₁₄Cl₂O₃
Density: 1.37 g/cm³
Boiling Point: 424.9 °C at 760 mmHg
Flash Point: 210.7 °C
Index of Refraction: 1.579
Molar Refractivity: 70.16 cm³
Molar Volume: 211 cm³
Surface Tension: 50.8 dyne/cm
Enthalpy of Vaporization: 71.62 kJ/mol
Vapour Pressure: 5.63E-08 mmHg at 25 °C
Storage Temp.: 2-8 °C
XLogP3-AA: 3.4
H-Bond Donor: 1
H-Bond Acceptor: 3
Rotatable Bond Count: 4
Exact Mass: 288.032
MonoIsotopic Mass: 288.032
Topological Polar Surface Area: 46.5
Heavy Atom Count: 18
Canonical SMILES: CC(C)(C(=O)O)OC1=CC=C(C=C1)C2CC2(Cl)Cl
InChI: InChI=1S/C13H14Cl2O3/c1-12(2,11(16)17)18-9-5-3-8(4-6-9)10-7-13(10,14)15/h3-6,10H,7H2,1-2H3,(H,16,17)
InChIKey: KPSRODZRAIWAKH-UHFFFAOYSA-N
EINECS: 257-744-6
Product Categories: Intracellular receptor

Uses

Ciprofibrate (CAS NO.52214-84-3) is a kind of lipid-lowering drugs. It has anti-platelet aggregation and the role of soluble fibrin.

Toxicity Data With Reference

otr-rat-orl 3650 mg/kg/1Y C

CNREA8 Cancer Research. 46 (1986),4601.

Safety Profile

Hazard Codes: Toxic T
Risk Statements: 45
R45:May cause cancer.
Safety Statements: 53-22-36/37/39-45
S53:Avoid exposure - obtain special instructions before use.
S22:Do not breathe dust.
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
WGK Germany: 3
RTECS: UF0880000
Questionable carcinogen with experimental tumorigenic data. Experimental reproductive data. Mutation data reported. When heated to decomposition it emits toxic fumes of Cl⁻.

Specification

Ciprofibrate (CAS NO.52214-84-3) is also named as 2-(p-(2,2-Dichlorocyclopropyl)phenoxy)-2-methylpropionic acid ; BRN 1984981 ; CCRIS 173 ; Ciprofibrato ; Ciprofibrato [INN-Spanish] ; Ciprofibratum ; Ciprofibratum [INN-Latin] ; UNII-F8252JGO9S ; WIN 35833 . Ciprofibrate (CAS NO.52214-84-3) is white or almost white crystalline powder.