2,3,4,5,6-Pentafluorobenzylzinc chloride solution
Product Information
Molecular Formula
C6F5CH2ZnCl
Molecular Weight
281.93
Description
2,3,4,5,6-Pentafluorobenzylzinc chloride solution is an organometallic reagent used in pharmaceutical research, specifically in drug synthesis applications. It facilitates the generation of selective compounds, which is critical for research into the treatment of complex diseases.
Synonyms
2,3,4,5,6-Pentafluorobenzylzinc chloride; 2 3 4 5 6-Pentafluorobenzylzinc chlorid&; 2,3,4,5,6-Pentafluorobenzylzinc chloride, 0.50 M in THF
IUPAC Name
chlorozinc(1+)1,2,3,4,5-pentafluoro-6-methanidylbenzene
SMILES
[CH2-]C1=C(C(=C(C(=C1F)F)F)F)F.Cl[Zn+]
InChI
InChI=1S/C7H2F5.ClH.Zn/c1-2-3(8)5(10)7(12)6(11)4(2)9/h1H21H/q-1+2/p-1
InChI Key
QQZFKKLEMKJJJH-UHFFFAOYSA-M
Boiling Point
65 °C
Flash Point
1.4 °F - closed cup
Density
0.99 g/mL at 25 °C
Storage
2-8°C
Safety Information
Hazards
H225 - H302 - H319 - H335 - H351
Precautionary Statement
P210 - P280 - P301 + P312 + P330 - P305 + P351 + P338 - P370 + P378 - P403 + P235
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
0
Exact Mass
279.905660 g/mol
Monoisotopic Mass
279.905660 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
156
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
2
Compound Is Canonicalized
Yes
