4-Chloro-4'-fluorobutyrophenone, 97%

Description

CAS: 3874-54-2 | C₁₀H₁₀ClFO | 200.64 g/mol

This Thermo Scientific Chemicals brand product was originally part of the Acros Organics product portfolio. Some documentation and label information may refer to the legacy brand. The original Acros Organics product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Specifications

Chemical Identifiers

• CAS: 3874-54-2
• Molecular Formula: C₁₀H₁₀ClFO
• Molecular Weight (g/mol): 200.64
• MDL Number: MFCD00001007
• InChI Key: HXAOUYGZEOZTJO-UHFFFAOYSA-N
• Synonym: 4-chloro-4'-fluorobutyrophenone, 4-chloro-1-4-fluorophenyl butan-1-one, 3-4-fluorobenzoyl propyl chloride, 4-fluorobenzoylpropyl chloride, 4-chloro-p-fluorobutyrophenone, 3-chloropropyl 4-fluorophenyl ketone, 1-butanone, 4-chloro-1-4-fluorophenyl, 4'-fluoro-4-chlorobutyrophenone, p-fluorobenzoylpropyl chloride, p-fluoro-4-chlorobutyrophenone
• PubChem CID: 19750
• IUPAC Name: 4-chloro-1-(4-fluorophenyl)butan-1-one
• SMILES: C1=CC(=CC=C1C(=O)CCCCl)F

• CAS Min %: 96.0
• CAS Max %: 100.0
• Melting Point: 5.0°C to 6.0°C
• Color: Green-Yellow
• Density: 1.2300g/mL
• Boiling Point: 130.0°C to 132.0°C (1.3 mbar)
• Flash Point: 152°C
• Infrared Spectrum: Authentic
• Assay Percent Range: 96% min. (GC)
• Packaging: Glass bottle
• Refractive Index: 1.5245 to 1.5265
• Linear Formula: FC₆H₄CO(CH₂)₃Cl
• Quantity: 100 g
• Beilstein: 07,IV,711
• Specific Gravity: 1.23
• Solubility Information: Solubility in water: 0.38g/L water (20°C). Other solubilities: soluble in methanol,ethanol,2-propanol,n,n-dmf,,acetone and dichloromethane
• Formula Weight: 200.64
• Percent Purity: 97%
• Physical Form: Oil
• Chemical Name or Material: 4-Chloro-4'-fluorobutyrophenone, 97%

Safety and Handling

Hazard Category	GHS Signal Word: Warning
Hazard Statement	GHS H Statement: Harmful if swallowed.
Precautionary Statement	GHS P Statement: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell. WARNING: The information provided on this web site was developed in compliance with European Union (EU) regulations and is correct to the best of our knowledge, information and belief at the date of its publication. The information given is designed only as a guide for safe handling and use. It is not to be considered as either a warranty or quality specification.
EINECSNumber	223-395-3
TSCA	TSCA
Recommended Storage	The substance may darken on ageing

SDS

RUO – Research Use Only