8.41808

1,2,6-Hexanetriol

for synthesis

• Synonym(s): 1,2,6-Hexanetriol
• Empirical Formula (Hill Notation): C₆H₁₄O₃
• CAS Number: 106-69-4
• Molecular Weight: 134.17
• UNSPSC Code: 12352104
• EC Index Number: 203-424-6
• NACRES: NA.22
• MDL number: MFCD00002976
• Assay: ≥96.0% (GC)
• Form: liquid

Properties

• vapor pressure: 0.01 hPa ( 20 °C)
• Quality Segment: 200
• assay: ≥96.0% (GC)
• form: liquid
• potency: 15500 mg/kg LD₅₀, oral (Rat)
• pH: 4.5-7.5 (25 °C, 300 g/L in H₂O)
• bp: 178 °C/6.5 hPa
• mp: -30 °C
• transition temp: flash point 195 °C
• density: 1.11 g/cm³ at 20 °C
• storage temp.: 2-30°C
• SMILES string: OC(CO)CCCCO
• InChI: 1S/C6H14O3/c7-4-2-1-3-6(9)5-8/h6-9H,1-5H2
• InChI key: ZWVMLYRJXORSEP-UHFFFAOYSA-N

Description

Application

1,2,6-Hexanetriol can be used as a reactant to synthesize:

• Unsaturated alcohols via rhenium-catalyzed deoxydehydration.
• Branched polyesters via melt polycondensation with dicarboxylic acids in the presence of tertrabutyl titanate as a catalyst.
• Shape memory polymer foams with enhanced degradation resistance.
• α-Hydroxyketones via catalytic selective oxidation of 1,2-diols.
• Primary tosylates via dibutyltin oxide-catalyzed tosylation with tosyl chloride.

Analysis Note

Assay (GC, area%): ≥ 96.0 % (a/a)
Density (d 20 °C/ 4 °C): 1.100 - 1.107
Identity (IR): passes test
Due to its specific melting range the product may be solid, liquid, a solidified melt or a supercooled melt.

Safety Information

• Storage Class: 10 - Combustible liquids
• wgk: WGK 1
• flash_point_f: 383.0 °F - closed cup
• flash_point_c: 195 °C - closed cup