Chloro(1,5-cyclooctadiene)methylpalladium(II)
Product Information
Molecular Formula
C9H15ClPd
Molecular Weight
265.09
Description
Catalyst for:• Addition polymerization reactions• Double carbonylation• Cyclization• Cyclometalation
Synonyms
Chloro(1,5-cyclooctadiene)methylpalladium(II), 97%; CHLOROMETHYL(1,5-CYCLOOCTADIENE)PALLADIUM(II); CHLORO(1,5-CYCLOOCTADIENE)METHYLPALLADIUM(II); CHLOROMETHYL(1,5-CYCLOOCTADIENE)PALLADIUM(II)
IUPAC Name
carbanidechloropalladium(1+)(1Z,5Z)-cycloocta-1,5-diene
SMILES
[CH3-].C1CC=CCCC=C1.Cl[Pd+]
InChI
InChI=1S/C8H12.CH3.ClH.Pd/c1-2-4-6-8-7-5-3-1/h1-2,7-8H,3-6H21H31H/q-1+2/p-1/b2-1-,8-7-
InChI Key
JRDZAJXSFXHJHS-PHFPKPIQSA-M
Melting Point
124-129 °C
Flash Point
206.6 °F - closed cup
Purity
97%
Safety Information
Hazards
H301 - H310 - H315 - H319 - H332 - H335 - H372 - H411
Precautionary Statement
P262 - P273 - P280 - P301 + P310 + P330 - P302 + P352 + P310 - P304 + P340 + P312
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
0
Exact Mass
263.98971 g/mol
Monoisotopic Mass
263.98971 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
77.4
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
2
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
3
Compound Is Canonicalized
Yes