Bis(triphenylphosphino)(2-methylphenyl)chloronickel(II)

Catalog Number	ACM27057096-1
CAS	27057-09-6
Synonyms	Chloro(2-methylphenyl)bis(triphenylphosphine)nickel(II)
Molecular Weight	711.9
Molecular Formula	C43H39ClNiP2
Canonical SMILES	CC1=CC=CC=[C-]1.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.Cl[Ni]
InChI	InChI=1S/2C18H15P.C7H7.ClH.Ni/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-7-5-3-2-4-6-7;/h2*1-15H;2-5H,1H3;1H;/q;-1;+1/p+1
InChI Key	BNEHQBISUSMIRX-UHFFFAOYSA-O
Melting Point	195-200 °C
Purity	99%
Appearance	Yellow powder
Complexity	725
Covalently-Bonded Unit Count	4
Defined Atom Stereocenter Count	0
Exact Mass	710.156895
Heavy Atom Count	47
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Monoisotopic Mass	710.156895
Rotatable Bond Count	6
Topological Polar Surface Area	0 Ų