[1,2-Bis(diphenylphosphino)ethane]dichloronickel(II) - CAS 14647-23-5
Catalog: |
BB043032 |
Product Name: |
[1,2-Bis(diphenylphosphino)ethane]dichloronickel(II) |
CAS: |
14647-23-5 |
Synonyms: |
1,2-Ethylenebis(diphenylphosphine)nickel dichloride; Nickel 1,2-Bis(diphenylphosphino)ethane dichloride; [1,2-Bis(diphenylphosphino)ethane]nickel(II) chloride; dppeNiCl2; Nickel(2+) ion [2-(diphenylphosphanyl)ethyl]diphenylphosphane dichloride; Dichloro[1,2-bis(diphenylphosphino)ethane]nickel(II) |
IUPAC Name: | 2-diphenylphosphanylethyl(diphenyl)phosphane;nickel(2+);dichloride |
Description: | Reactant involved in: Kumada catalyst-transfer polycondensation; Oxidation of carboranyl phosphine ligands; Synthesis of nickel-iron dithiolato hydrides; Ullmann reactions - homocoupling reactionsCo-catalyst for hydroformylation of alcohols for the synthesis of quaternary carbon centersCatalyst for Wacker-type intramolecular aerobic oxidative amination of alkenes. |
Molecular Weight: | 528.02 |
Molecular Formula: | C26H24Cl2NiP2 |
Canonical SMILES: | C1=CC=C(C=C1)P(CCP(C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.[Cl-].[Cl-].[Ni+2] |
InChI: | InChI=1S/C26H24P2.2ClH.Ni/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;;;/h1-20H,21-22H2;2*1H;/q;;;+2/p-2 |
InChI Key: | XXECWTBMGGXMKP-UHFFFAOYSA-L |
Melting Point: | 263-265 °C |
Purity: | > 96.0 % (T) |
Appearance: | Orange to amber to dark red powder to crystal |
Storage: | Refrigerator |
GHS Hazard Statement: | H302 (87.5%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (87.5%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H317 (16.67%): May cause an allergic skin reaction [Warning Sensitization, Skin]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (87.5%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H334 (89.58%): May cause allergy or asthma symptoms or breathing difficulties if inhaled [Danger Sensitization, respiratory]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]; H350 (89.58%): May cause cancer [Danger Carcinogenicity]; H351 (10.42%): Suspected of causing cancer [Warning Carcinogenicity] |
Precautionary Statement: | P201 P261 P280 P305+P351+P338 P308+P313 |
Signal Word: | Danger |
Complexity: | 336 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 4 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 526.008372 |
Formal Charge: | 0 |
Heavy Atom Count: | 31 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 526.008372 |
Rotatable Bond Count: | 7 |
Topological Polar Surface Area: | 0 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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