1,1,1,2,2,3,3-heptafluoro-3-[(trifluoroethenyl)oxy]propane

• ChemBase ID: 9709
• Molecular Formular: C5F10O
• Molecular Mass: 266.036932
• Monoisotopic Mass: 265.97894682
• SMILES: C(F)(F)(OC(=C(F)F)F)C(C(F)(F)F)(F)F
• Canonical SMILES: FC(=C(OC(C(C(F)(F)F)(F)F)(F)F)F)F
• InChI: InChI=1S/C5F10O/c6-1(7)2(8)16-5(14,15)3(9,10)4(11,12)13
• InChIKey: KHXKESCWFMPTFT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 1,1,1,2,2,3,3-heptafluoro-3-[(trifluoroethenyl)oxy]propane
• IUPAC Traditional name: 1,1,1,2,2,3,3-heptafluoro-3-[(trifluoroethenyl)oxy]propane
• Synonyms: Heptafluoropropyl trifluorovinyl ether; PPVE; 1,1,1,2,2,3,3-Heptafluoro-3-[(trifluoroethenyl)oxy]propane; Heptafluoropropyl trifluoroethenyl ether; Heptafluoropropyl trifluorovinyl ether; Perfluoro(propyl vinyl ether) 97%

Database IDs

• CAS Number: 1623-05-8
• MDL Number: MFCD00236685
• PubChem SID: 160973016
• PubChem CID: 15388

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 3.8360734
• LogD (pH = 7.4): 3.8360734
• Log P: 3.8360734
• Molar Refractivity: 48.7327 cm^3
• Polarizability: 10.746139 Å^3
• Polar Surface Area: 9.23 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: -70°C
• Boiling Point: 35-36°C
• Flash Point: -20°C
• Density: 1.53

Safety Information

• Storage Warning: FLAMMABLE; Highly Flammable/Harmful/Irritant/Hygroscopic/Keep Cold
• TSCA Listed: false

Product Information

• Purity: 98%

DETAILS

Apollo Scientific Ltd - PC4513L

Useful intermediate and monomer; the co-polymer with tetrafluoroethylene is sold as Teflon PFA.. Cylinder