D44952

Dibutylamine

≥98%

• Synonym(s): N-butylbutan-1-amine
• Linear Formula: (CH₃CH₂CH₂CH₂)₂NH
• CAS Number: 111-92-2
• Molecular Weight: 129.24
• Beilstein/REAXYS Number: 506001
• EC Number: 203-921-8
• MDL number: MFCD00009429
• UNSPSC Code: 12352100
• PubChem Substance ID: 24893877
• NACRES: NA.22

Properties

• vapor density: 4.46 (vs air)
• Quality Level: 200
• vapor pressure: 1.9 mmHg ( 20 °C)
• assay: ≥98%
• form: liquid
• autoignition temp.: 594 °F
• expl. lim.: 10 %
• refractive index: n20/D 1.417 (lit.)
• pH: 11.1 (20 °C, 1 g/L)
• bp: 159 °C (lit.)
• mp: −62 °C (lit.)
• density: 0.767 g/mL at 25 °C (lit.)
• SMILES string: CCCCNCCCC
• InChI: 1S/C8H19N/c1-3-5-7-9-8-6-4-2/h9H,3-8H2,1-2H3
• InChI key: JQVDAXLFBXTEQA-UHFFFAOYSA-N

Description

Application

• Dibutylamine is extensively used in palladium-catalyzed cross-coupling with aryl halides to synthesize arylamines, popularly known as Buchwald–Hartwig amination.
• It can be used in the oxone-mediated annulation of 2-aminobenzamides and 1,2-diaminobenzenes to synthesize 2,3-dihydroquinazolin-4(1H)-ones and 1H-benzimidazoles, respectively.
• It can also be used in the one-pot multicomponent reactions to synthesize tetra- and penta-substituted polyfunctional dihydropyrroles.

Safety Information

• pictograms: GHS02,GHS06,GHS05
• signalword: Danger
• hcodes: H226,H302,H311,H314,H330
• pcodes: P210 - P280 - P301 + P312 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 2 Inhalation - Acute Tox. 3 Dermal - Acute Tox. 4 Oral - Eye Dam. 1 - Flam. Liq. 3 - Skin Corr. 1A
• Storage Class: 3 - Flammable liquids
• wgk_germany: WGK 1
• flash_point_f: 104.9 °F - closed cup
• flash_point_c: 40.5 °C - closed cup
• ppe: Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter