4-Chloro-4'-fluorobutyrophenone , 97% , 3874-54-2

CAS NO.：3874-54-2

Empirical Formula: C10H10ClFO

Molecular Weight: 200.64

MDL number: MFCD00001007

EINECS: 223-395-3

PRODUCT Properties

• Melting point: 5-6 °C
• Boiling point: 130-132 °C (0.97513 mmHg)
• Density: 1.22 g/mL at 25 °C(lit.)
• refractive index: n20/D 1.5255(lit.)
• Flash point: >230 °F
• storage temp.: Inert atmosphere,Room Temperature
• solubility: Chloroform (Sparingly), Ethyl Acetate (Slightly), Methanol (Slightly)
• form: Oil
• color: Slightly yellow-greenish clear
• PH: 4.05 at 23.1℃ and 10g/L
• Water Solubility: 0.38 g/L (20 ºC)
• BRN: 608741
• InChI: 1S/C10H10ClFO/c11-7-1-2-10(13)8-3-5-9(12)6-4-8/h3-6H,1-2,7H2
• InChIKey: HXAOUYGZEOZTJO-UHFFFAOYSA-N
• SMILES: Fc1ccc(cc1)C(=O)CCCCl
• LogP: 2.84 at 30℃
• CAS DataBase Reference: 3874-54-2(CAS DataBase Reference)
• NIST Chemistry Reference: 1-Butanone, 4-chloro-1-(4-fluorophenyl)-(3874-54-2)
• EPA Substance Registry System: 1-Butanone, 4-chloro-1-(4-fluorophenyl)- (3874-54-2)

Description and Uses

4-Chloro-4‘-fluorobutyrophenone is a pharmaceutical intermediate compound suitable for the production of antipsychotics and active pharmaceutical ingredients (APIs) for the treatment of depression.4-Chloro-4’-fluorobutyrophenone can be used as a synthesis of trifluprednis, azaperone, melperone, Melperone, Timiperone, Bromoperidol, Haloperidol, Benzoperidol, Droperidol, Fluanisone and other APIs as pharmaceutical intermediates.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H302
• Precautionary statements: P264-P270-P301+P312a-P330-P501a
• PPE: Eyeshields, Gloves
• Hazard Codes: Xn,Xi
• Risk Statements: 22-36/37/38-20/21/22
• Safety Statements: 24/25-36-26
• WGK Germany: 3
• Hazard Note: Irritant
• TSCA: TSCA listed
• HS Code: 2914790090
• Storage Class: 10 - Combustible liquids
• Hazard Classifications: Aquatic Chronic 2; Skin Sens. 1B
• REACH Registrations: Active