bis((2-aminoethyl)di-tert-butyl)phosphane); dichlororuthenium

• ChemBase ID: 141380
• Molecular Formular: C20H48Cl2N2P2Ru
• Molecular Mass: 550.532042
• Monoisotopic Mass: 550.17132717
• SMILES: CC(C)(C)P(CCN)C(C)(C)C.CC(C)(C)P(CCN)C(C)(C)C.Cl[Ru]Cl
• Canonical SMILES: NCCP(C(C)(C)C)C(C)(C)C.NCCP(C(C)(C)C)C(C)(C)C.Cl[Ru]Cl
• InChI: InChI=1S/2C10H24NP.2ClH.Ru/c2*1-9(2,3)12(8-7-11)10(4,5)6;;;/h2*7-8,11H2,1-6H3;2*1H;/q;;;;+2/p-2
• InChIKey: FUALRLYVUZSWKT-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: bis((2-aminoethyl)di-tert-butyl)phosphane); dichlororuthenium
• IUPAC Traditional name: bis((2-aminoethyl)di-tert-butyl)phosphane); dichlororuthenium
• Synonyms: Dichlorobis[2-(di-tert-butylphosphino)ethylamine]ruthenium(II); 二氯双[2-(二-叔丁基膦)乙胺]钌(II)

Database IDs

• MDL Number: MFCD07782003
• PubChem SID: 162235614
• PubChem CID: 71310624

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -2.4041939
• LogD (pH = 7.4): -1.484791
• Log P: 1.0397
• Molar Refractivity: 62.7168 cm^3
• Polarizability: 23.41728 Å^3
• Polar Surface Area: 26.02 Å^2
• Rotatable Bonds: 8
• Lipinski's Rule of Five: false

PROPERTIES

Physical Property

• Melting Point: 247-263 °C

Safety Information

• European Hazard Symbols: Irritant (Xi)
• German water hazard class: 3
• Risk Statements: 36/37/38
• Safety Statements: 26
• GHS Pictograms: GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H315-H319-H335
• GHS Precautionary statements: P261-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves

Product Information

• Purity: 97%
• Empirical Formula (Hill Notation): C20H48Cl2N2P2Ru

DETAILS

Sigma Aldrich - 664987

Packaging
1 g in glass bottle
250 mg in glass bottle
Legal Information
Sold under license from Kanata Chemical Technologies Inc. for research purposes only.