Bis(tricyclohexylphosphine)nickel(II) Dichloride

C₃₆H₆₆Cl₂NiP₂CAS 19999-87-2690.46 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₃₆H₆₆Cl₂NiP₂
Molar mass: 690.46 g/mol
Exact mass: 688.3370 Da
logP: 14.31Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 6

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H317 May cause an allergic skin reaction97.6% of notifiers
H351 Suspected of causing cancer97.6% of notifiers

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P261, P264, P270, P272, P280, P301+P317, P302+P352, P318, P321, P330, P333+P317, P362+P364, P405, P501

Identifiers

CAS number

19999-87-2

SMILES

C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.C1CCC(CC1)P(C2CCCCC2)C3CCCCC3.Cl[Ni]Cl

InChIKey

YOCBOYPGZVFUCQ-UHFFFAOYSA-L

InChI

InChI=1S/2C18H33P.2ClH.Ni/c2*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;;;/h2*16-18H,1-15H2;2*1H;/q;;;;+2/p-2

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Names and synonyms

1 names

Bis(tricyclohexylphosphine)nickel(II) chloride, 99%

Work with Bis(tricyclohexylphosphine)nickel(II) Dichloride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Tricyclohexylphosphine2622-14-2Parent compound Dichlorobis(tricyclohexylphosphine)palladium(II)29934-17-6Salt Tricyclohexylphosphonium tetrafluoroborate58656-04-5Salt

Similar compounds

Tricyclopentylphosphine7650-88-661 % similar Bis(tricyclohexylphosphine)palladium(0)33309-88-557 % similar Chlorodicyclohexylphosphine16523-54-943 % similar Bis(dicyclohexylphosphino)methane137349-65-639 % similar 1,2-Bis(dicyclohexylphosphino)ethane23743-26-239 % similar 1,3-Bis(dicyclohexylphosphino)propane103099-52-138 % similar Dichlorobis(tributylphosphine)nickel(II)15274-43-833 % similar Di-tert-butylcyclohexylphosphine436865-11-133 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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