4,4,5,5,5-Pentafluoro-1-pentanol , 95% , 148043-73-6

CAS NO.：148043-73-6

Empirical Formula: C5H7F5O

Molecular Weight: 178.1

MDL number: MFCD00153224

EINECS: 421-360-9

PRODUCT Properties

• Boiling point: 62-64 °C35 mm Hg(lit.)
• Density: 1.35 g/mL at 25 °C(lit.)
• vapor pressure: 1.1-155.2hPa at 25-80.3℃
• refractive index: n20/D 1.33(lit.)
• Flash point: 145 °F
• storage temp.: 2-8°C
• solubility: Chloroform
• pka: 14.77±0.10(Predicted)
• form: Liquid
• color: Clear colorless
• InChI: InChI=1S/C5H7F5O/c6-4(7,2-1-3-11)5(8,9)10/h11H,1-3H2
• InChIKey: QROUUECTKRZFHF-UHFFFAOYSA-N
• SMILES: C(O)CCC(F)(F)C(F)(F)F
• LogP: 1.59 at 25℃ and pH7
• CAS DataBase Reference: 148043-73-6(CAS DataBase Reference)
• EPA Substance Registry System: 3-(Perfluoroethyl)propanol (148043-73-6)

Description and Uses

4,4,5,5,5-Pentafluoro-1-pentanol (PFP; Pentafluoropentanol) is an essential building block primarily used in the commercial manufacture of the API. It is typically activated with a sulfonate leaving group and displaced selectively by the sulfur atom in 9-mercapto-1-nonanol to make 9-[(4,4,5,5,5-pentafluoropentyl)-thio]-1-nonanol (FVS). FVS is subsequently converted into a bromide and coupled with the steroid portion to make fulvestrant. First approved by the FDA in 2002, fulvestrant is a medication used to treat hormone receptor (HR)-positive metastatic breast cancer in postmenopausal women with disease progression.

4,4,5,5,5-Pentafluoro-1-pentanol may be used in the preparation of chlorine-capped telechelic poly(methyl methacrylate)s.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H319
• Precautionary statements: P305+P351+P338
• Hazard Codes: Xi,F
• Risk Statements: 36-36/37/38
• Safety Statements: 26-36
• RIDADR: 1993
• WGK Germany: 2
• Hazard Note: Irritant
• HazardClass: FLAMMABLE
• HS Code: 29055900