boranylidenetrimethylamine

• ChemBase ID: 148773
• Molecular Formular: C3H11BN
• Molecular Mass: 71.93714
• Monoisotopic Mass: 72.09845476
• SMILES: [BH2-][N+](C)(C)C
• Canonical SMILES: [BH2-][N+](C)(C)C
• InChI: InChI=1S/C3H12BN/c1-5(2,3)4/h1-4H3
• InChIKey: KQVSXUGMDCAISO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: boranylidenetrimethylamine
• IUPAC Traditional name: boranylidenetrimethylamine
• Synonyms: NSC 10220; NSC 145941; NSC 53323; Trihydro(trimethylamine)boron; Trimethylamine borane; Borane trimethylamine complex; 三甲胺硼烷; 硼烷三甲胺络合物

Database IDs

• CAS Number: 75-22-9
• EC Number: 200-850-4
• MDL Number: MFCD00012420
• Beilstein Number: 3905060
• PubChem SID: 162242948; 24849578; 24850786
• PubChem CID: 6327651

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 0
• LogD (pH = 5.5): -4.7170744
• LogD (pH = 7.4): -4.7170744
• Log P: -4.7170744
• Molar Refractivity: 22.9901 cm^3
• Polarizability: 10.122457 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 92-94 °C(lit.); 93-95 °C
• Boiling Point: 172 °C(lit.)

Safety Information

• European Hazard Symbols: Flammable (F); Irritant (Xi); Harmful (Xn)
• UN Number: 1325
• German water hazard class: 3
• Hazard Class: 4.1
• Packing Group: 2
• Risk Statements: 11-36/37/38
• Safety Statements: 14-16-26-36; 16-26-36
• GHS Pictograms: GHS02; GHS07
• GHS Signal Word: Danger
• GHS Hazard statements: H228-H315-H319-H335
• GHS Precautionary statements: P210-P261-P305 + P351 + P338
• RID/ADR: UN 1325 4.1/PG 2

Product Information

• Purity: ≥95.0% (T); 97%
• Grade: purum
• Linear Formula: (CH3)3N · BH3

DETAILS

Sigma Aldrich - 178985

Packaging
5, 25, 100 g in glass bottle
Application
Reducing agent for the preparation of plate-type palladium-zinc oxide catalyst1Reagent for chemical vapor generation and spectrometry determination of elements using amineboranes and cyanotrihydroborate(III) reagents2Catalyst for:
• Regioselective reductive opening of benzylidene acetal glycosides3
• Polarity reversal4Used to study
• Electrodeposition condition effects on magnetism of cobalt-iron magnetic films5
• Boron-nitrogen bond dissociation energies and physiological activities of boronated compounds6
Stable, easy-to-handle source of borane for the reduction of ketones and Schiff bases and for the hydroboration of olefins.

Sigma Aldrich - 15591

Other Notes
Review7
Application
Reducing agent for the preparation of plate-type palladium-zinc oxide catalyst1Reagent for chemical vapor generation and spectrometry determination of elements using amineboranes and cyanotrihydroborate(III) reagents2Catalyst for:
• Regioselective reductive opening of benzylidene acetal glycosides3
• Polarity reversal4Used to study
• Electrodeposition condition effects on magnetism of cobalt-iron magnetic films5
• Boron-nitrogen bond dissociation energies and physiological activities of boronated compounds6