lithium(1+) ion ethanolate

• ChemBase ID: 108951
• Molecular Formular: C2H5LiO
• Molecular Mass: 52.0015
• Monoisotopic Mass: 52.05004433
• SMILES: [Li+].CC[O-]
• Canonical SMILES: [O-]CC.[Li+]
• InChI: InChI=1S/C2H5O.Li/c1-2-3;/h2H2,1H3;/q-1;+1
• InChIKey: AZVCGYPLLBEUNV-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: lithium(1+) ion ethanolate
• IUPAC Traditional name: LithoTab ethoxide; lithium(1+) ion ethoxide
• Synonyms: LITHIUM ETHYLATE; Lithium ethoxide; Lithium ethoxide solution; 乙醇锂; 乙醇锂 溶液

Database IDs

• CAS Number: 2388-07-0
• MDL Number: MFCD00050493
• Beilstein Number: 3909950
• PubChem SID: 162094920; 24864907; 24864903; 24864906
• PubChem CID: 23661847

CALCULATED PROPERTIES

• Acid pKa: 16.470615
• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -0.1617691
• LogD (pH = 7.4): -0.1617691
• Log P: -0.1617691
• Molar Refractivity: 23.5602 cm^3
• Polarizability: 4.748913 Å^3
• Polar Surface Area: 23.06 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Boiling Point: 67 °C
• Flash Point: -20.2 °F; -29 °C; 48.2 °F; 9 °C
• Density: 0.821 g/mL at 25 °C; 0.895 g/mL at 25 °C

Safety Information

• European Hazard Symbols: Corrosive (C); Flammable (F); Irritant (Xi)
• UN Number: 2924; 3206; 3274
• German water hazard class: 3
• Hazard Class: 3; 4.2
• Packing Group: 2
• Risk Statements: 11-14-19-36/37/38; 11-14-34; 11-14-36/38
• Safety Statements: 16-26; 16-26-36/37/39-43-45
• GHS Pictograms: GHS02; GHS05; GHS07
• GHS Signal Word: Danger
• GHS Hazard statements: H225-H251-H314; H225-H251-H314-H335; H251-H314
• GHS Precautionary statements: P210-P235 + P410-P261-P280-P305 + P351 + P338-P310; P210-P235 + P410-P280-P305 + P351 + P338-P310; P235 + P410-P280-P305 + P351 + P338-P310
• 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; Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 2924 3/PG 2; UN 3206 4.2/PG 2; UN 3274 3/PG 2
• Supplemental Hazard Statements: May form explosive peroxides., Reacts violently with water.; Reacts violently with water.

Product Information

• Purity: 95%
• Concentration: 1.0 M in ethanol; 1.0 M in THF
• Linear Formula: CH3CH2OLi

DETAILS

MP Biomedicals - 05209337

MP Biomedicals Rare Chemical collection

Sigma Aldrich - 400203

Packaging
5, 25 g in glass bottle

Sigma Aldrich - 400246

Packaging
100 mL in Sure/Seal™

Sigma Aldrich - 400254

Packaging
100 mL in Sure/Seal™