2,2,3,3,3-Pentafluoropropyl acrylate
Product Information
Molecular Formula
C6H5F5O2
Molecular Weight
204.09
Description
2,2,3,3,3-Pentafluoropropyl acrylate (CAS# 356-86-5) is a useful research chemical.
Synonyms
2,2,3,3,3-pentafluoropropyl prop-2-enoate
IUPAC Name
2,2,3,3,3-pentafluoropropyl prop-2-enoate
SMILES
C=CC(=O)OCC(C(F)(F)F)(F)F
InChI
InChI=1S/C6H5F5O2/c1-2-4(12)13-3-5(7,8)6(9,10)11/h2H,1,3H2
InChI Key
JDVGNKIUXZQTFD-UHFFFAOYSA-N
Boiling Point
50 °C (100 torr)
Melting Point
49-50 °C
Flash Point
23 °C
Purity
95 %
Density
1.32 g/cm3
Storage
Keep Cold
Refractive Index
1.3360
LogP
1.91320
Safety Information
Hazards
H226 - H302 + H312 + H332 - H319 - H335
Precautionary Statement
P210 - P280 - P301 + P312 + P330 - P302 + P352 + P312 - P304 + P340 + P312 - P305 + P351 + P338
Signal Word
Warning
Computed Properties
XLogP3
2.5
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
7
Rotatable Bond Count
4
Exact Mass
204.02097021 g/mol
Monoisotopic Mass
204.02097021 g/mol
Topological Polar Surface Area
26.3Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
208
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes