sodium diethylalumanuide

• ChemBase ID: 138430
• Molecular Formular: C4H11AlNa
• Molecular Mass: 109.101448
• Monoisotopic Mass: 109.05738326
• SMILES: CC[AlH-]CC.[Na+]
• Canonical SMILES: CC[AlH-]CC.[Na+]
• InChI: InChI=1S/2C2H5.Al.Na/c2*1-2;;/h2*1H2,2H3;;/q;;-1;+1
• InChIKey: VDZSAGCGQWTCIZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: sodium diethylalumanuide
• IUPAC Traditional name: sodium diethylalumanuide
• Synonyms: OMH-1; Sodium aluminum diethyl dihydride; Sodium diethyldihydroaluminate solution; 二乙基二氢化铝钠; 二乙基二氢铝酸钠 溶液

Database IDs

• CAS Number: 17836-88-3
• MDL Number: MFCD00011701
• PubChem SID: 162232686
• PubChem CID: 16687524

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): 1.754
• LogD (pH = 7.4): 1.754
• Log P: 1.754
• Molar Refractivity: 22.2938 cm^3
• Polarizability: 10.980513 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Concentration: 25 wt. % in toluene
• Impurities: 5% tetrahydrofuran
• Empirical Formula (Hill Notation): C4H12AlNa

DETAILS

Sigma Aldrich - 257141

Packaging
Packaged under nitrogen in Sure/Pac™ metal cylinder

Sigma Aldrich - 189111

Packaging
Packaged under nitrogen in poly-coated Sure/Seal™ bottles
Legal Information
Sure/Seal is a trademark of Sigma-Aldrich Co. LLC