diethyl(lithio)amine

• ChemBase ID: 137513
• Molecular Formular: C4H10LiN
• Molecular Mass: 79.0699
• Monoisotopic Mass: 79.09732888
• SMILES: [Li]N(CC)CC
• Canonical SMILES: CCN(CC)[Li]
• InChI: InChI=1S/C4H10N.Li/c1-3-5-4-2;/h3-4H2,1-2H3;/q-1;+1
• InChIKey: AHNJTQYTRPXLLG-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: diethyl(lithio)amine
• IUPAC Traditional name: diethyl(lithio)amine
• Synonyms: Lithium diethylamide; 二乙氨基锂

Database IDs

• CAS Number: 816-43-3
• EC Number: 212-433-4
• MDL Number: MFCD00040489
• PubChem SID: 162231775; 24857833
• PubChem CID: 11137085

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 0.2056544
• LogD (pH = 7.4): 0.4685667
• Log P: 0.4732
• Molar Refractivity: 23.3906 cm^3
• Polarizability: 10.824506 Å^3
• Polar Surface Area: 3.24 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• European Hazard Symbols: Corrosive (C); Flammable (F)
• UN Number: 3393
• German water hazard class: 3
• Hazard Class: 4.2
• Packing Group: 1
• Risk Statements: 17-34
• Safety Statements: 16-26-27-36/37/39-45
• GHS Pictograms: GHS02; GHS05
• GHS Signal Word: Danger
• GHS Hazard statements: H250-H261-H314
• GHS Precautionary statements: P222-P231 + P232-P280-P305 + P351 + P338-P310-P422
• Personal Protective Equipment: Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
• RID/ADR: UN 3393 4.2/PG 1

Product Information

• Purity: ≥95%
• Linear Formula: (C2H5)2NLi

DETAILS

Sigma Aldrich - 296074

Packaging
10, 50 g in glass bottle