{[bis(propan-2-yl)amino]magnesio}bis(propan-2-yl)amine

• ChemBase ID: 141158
• Molecular Formular: C12H28MgN2
• Molecular Mass: 224.66912
• Monoisotopic Mass: 224.21029061
• SMILES: CC(C)N(C(C)C)[Mg]N(C(C)C)C(C)C
• Canonical SMILES: CC(N(C(C)C)[Mg]N(C(C)C)C(C)C)C
• InChI: InChI=1S/2C6H14N.Mg/c2*1-5(2)7-6(3)4;/h2*5-6H,1-4H3;/q2*-1;+2
• InChIKey: XDBOBNVQEBSKFO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: {[bis(propan-2-yl)amino]magnesio}bis(propan-2-yl)amine
• IUPAC Traditional name: [(diisopropylamino)magnesio]diisopropylamine
• Synonyms: Magnesium diisopropylamide; Magnesium bis(diisopropyl)amide solution; 二异丙基氨基镁; 双(二异丙胺基)镁 溶液

Database IDs

• CAS Number: 23293-23-4
• MDL Number: MFCD03093019
• PubChem SID: 162235393
• PubChem CID: 10944115

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -2.405916
• LogD (pH = 7.4): -1.5142071
• Log P: 1.7988
• Molar Refractivity: 64.4564 cm^3
• Polarizability: 27.992676 Å^3
• Polar Surface Area: 6.48 Å^2
• Rotatable Bonds: 6
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Flash Point: <-13 °F; <-25 °C
• Density: 0.871 g/mL at 25 °C

Safety Information

• European Hazard Symbols: Corrosive (C); Flammable (F)
• UN Number: 3399
• German water hazard class: 3
• Hazard Class: 4.3
• Packing Group: 2
• Risk Statements: 11-14/15-19-35-37-40-52/53-65-68
• Safety Statements: 26-36/37/39-43-45-61-62
• GHS Pictograms: GHS02; GHS05; GHS06; GHS08
• GHS Signal Word: Danger
• GHS Hazard statements: H225-H261-H304-H314-H331-H335-H341-H351-H412
• GHS Precautionary statements: P210-P231 + P232-P261-P273-P280-P422
• RID/ADR: UN 3399 4.3/PG 2
• Supplemental Hazard Statements: May form explosive peroxides., Reacts violently with water.
• Storage Temperature: 2-8°C

Product Information

• Concentration: 0.70 M in THF; 18 % (w/w)
• Linear Formula: Mg[((CH3)2CH)2N]2

DETAILS

Sigma Aldrich - 703532

Packaging
100, 800 mL in Sure/Seal™