dichloromagnesium; triethylamine

• ChemBase ID: 144194
• Molecular Formular: C6H15Cl2MgN
• Molecular Mass: 196.401
• Monoisotopic Mass: 195.04319655
• SMILES: CCN(CC)CC.[Mg](Cl)Cl
• Canonical SMILES: CCN(CC)CC.Cl[Mg]Cl
• InChI: InChI=1S/C6H15N.2ClH.Mg/c1-4-7(5-2)6-3;;;/h4-6H2,1-3H3;2*1H;/q;;;+2/p-2
• InChIKey: FMUNKBAIXLTEGC-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: dichloromagnesium; triethylamine
• IUPAC Traditional name: magnesium chloride; triethylamine
• Synonyms: MgCl2-Et3N Base System; Magnesium chloride triethylamine solution

Database IDs

• MDL Number: MFCD18427918
• PubChem SID: 162238411
• PubChem CID: 71311043

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -2.2147028
• LogD (pH = 7.4): -1.4690653
• Log P: 1.2605933
• Molar Refractivity: 34.2339 cm^3
• Polarizability: 13.342089 Å^3
• Polar Surface Area: 3.24 Å^2
• Rotatable Bonds: 3
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Flash Point: 48.2 °F; 9 °C
• Density: 0.850 g/mL at 25 °C

Safety Information

• European Hazard Symbols: Flammable (F); Toxic (T)
• German water hazard class: 1
• Risk Statements: 11-23/24/25-34-39/23/24/25
• Safety Statements: 16-26-36/37/39-45
• GHS Pictograms: GHS02; GHS05; GHS06; GHS08
• GHS Signal Word: Danger
• GHS Hazard statements: H225-H301-H311-H314-H331-H335-H370
• GHS Precautionary statements: P210-P260-P280-P301 + P310-P305 + P351 + P338-P310

Product Information

• Concentration: 0.5 M in methanol
• Empirical Formula (Hill Notation): C6H15N · MgCl2

DETAILS

Sigma Aldrich - 737437

Packaging
5, 25 mL in glass bottle