(dichlorophosphanyl)diethylamine

• ChemBase ID: 149875
• Molecular Formular: C4H10Cl2NP
• Molecular Mass: 174.008661
• Monoisotopic Mass: 172.99279132
• SMILES: CCN(CC)P(Cl)Cl
• Canonical SMILES: CCN(P(Cl)Cl)CC
• InChI: InChI=1S/C4H10Cl2NP/c1-3-7(4-2)8(5)6/h3-4H2,1-2H3
• InChIKey: BPEMCEULJQTJMI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (dichlorophosphanyl)diethylamine
• IUPAC Traditional name: (dichlorophosphanyl)diethylamine
• Synonyms: (Diethylamido)dichlorophosphite; (Diethylamino)dichlorophosphine; (Diethylamino)phosphine dichloride; Dichloro(diethylamido)phosphine; Dichloro(diethylamino)phosphine; Dichlorophosphorous diethylamide; Diethylphosphoramidous dichloride; 二乙基二氯磷

Database IDs

• CAS Number: 1069-08-5
• MDL Number: MFCD00013614
• PubChem SID: 162244037; 24862338
• PubChem CID: 2733289

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 2.0729942
• LogD (pH = 7.4): 2.073
• Log P: 2.073
• Molar Refractivity: 42.4992 cm^3
• Polarizability: 16.096699 Å^3
• Polar Surface Area: 3.24 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 179 °C(lit.)
• Flash Point: 181.4 °F; 83 °C
• Density: 1.196 g/mL at 25 °C(lit.)
• Refractive Index: n20/D 1.497(lit.)

Safety Information

• European Hazard Symbols: Corrosive (C)
• UN Number: 3265
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2
• Risk Statements: 34
• Safety Statements: 26-36/37/39-43-45
• GHS Pictograms: GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H314
• GHS Precautionary statements: P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 3265 8/PG 2
• Storage Temperature: 2-8°C

Product Information

• Purity: 97%
• Linear Formula: (C2H5)2NPCl2

DETAILS

Sigma Aldrich - 362891

Packaging
5 g in glass bottle
Application
Reagent for the preparation of diethylaminophosphine-metal complexes1,2 and the phosphitylation of alcohols.2,3