Bis[4-(1H,1H,2H,2H-perfluorodecyl)phenyl]phenylphosphine
Product Information
Molecular Formula
C38H21F34P
Molecular Weight
1154.49
Description
Bis[4-(1H,1H,2H,2H-perfluorodecyl)phenyl]phenylphosphine (CAS# 892154-91-5 ) is a useful research chemical.
Synonyms
bis[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)phenyl]-phenylphosphane
IUPAC Name
bis[4-(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl)phenyl]-phenylphosphane
SMILES
C1=CC=C(C=C1)P(C2=CC=C(C=C2)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C3=CC=C(C=C3)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C38H21F34P/c39-23(40,25(43,44)27(47,48)29(51,52)31(55,56)33(59,60)35(63,64)37(67,68)69)16-14-18-6-10-21(11-7-18)73(20-4-2-1-3-5-20)22-12-8-19(9-13-22)15-17-24(41,42)26(45,46)28(49,50)30(53,54)32(57,58)34(61,62)36(65,66)38(70,71)72/h1-13H,14-17H2
InChI Key
GMHNZJNJORCMQJ-UHFFFAOYSA-N
Melting Point
65-71 °C
Flash Point
Not applicable
Purity
≥ 95 % (GC)
LogP
15.32880
Safety Information
Hazards
H315 - H319 - H335
Precautionary Statement
P261 - P305 + P351 + P338
Signal Word
Warning
Computed Properties
XLogP3
17.5
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
34
Rotatable Bond Count
21
Exact Mass
1154.0837952 g/mol
Monoisotopic Mass
1154.0837952 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
73
Formal Charge
0
Complexity
1700
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
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| WO-2020152200-A1 | Process for preparation of heteroarylketones | 2019-01-25 |
| JP-5169247-B2 | Method for producing curable fluorine-containing polyether composition | 2008-01-25 |
