8.01964

1,3-Butanediol

for synthesis

• Synonyme(s) : (±)-1,3-Butanediol, 1,3-Butylene glycol
• Formule linéaire : CH₃CH(OH)CH₂CH₂OH
• Numéro CAS: 107-88-0
• Poids moléculaire : 90.12
• UNSPSC Code: 12352104
• NACRES: NA.22
• EC Index Number: 203-529-7
• MDL number: MFCD00004554
• Beilstein/REAXYS Number: 1731276
• Assay: ≥99% (GC)
• Grade: synthesis grade
• Bp: 203-204 °C (lit.)
• Vapor pressure: 0.06 mmHg ( 20 °C)

Propriétés

• grade: synthesis grade
• Quality Segment: 200
• vapor density: 3.1 (20 °C, vs air)
• vapor pressure: 0.06 mmHg ( 20 °C)
• assay: ≥99% (GC)
• form: liquid
• autoignition temp.: 741 °F
• potency: 18610 mg/kg LD₅₀, oral (Rat), >20000 mg/kg LD₅₀, skin (Rabbit)
• expl. lim.: 1.9-12.6 % (v/v)
• dilution: (for synthesis)
• refractive index: n20/D 1.44 (lit.)
• pH: 6.1 (20 °C, 500 g/L in H₂O)
• bp: 203-204 °C (lit.)
• mp: -57 °C
• transition temp: flash point 115 °C
• solubility: >500 g/L (miscible)
• density: 1.005 g/mL at 25 °C (lit.)
• storage temp.: 2-30°C
• SMILES string: CC(O)CCO
• InChI: 1S/C4H10O2/c1-4(6)2-3-5/h4-6H,2-3H2,1H3
• InChI key: PUPZLCDOIYMWBV-UHFFFAOYSA-N

Description

Application

• Process design for acidic and alcohol based deep eutectic solvent pretreatment and high pressure homogenization of palm bunches for nanocellulose: Studies DES based on ChCl and 1,3-butanediol, offering insights into process optimizations for clear solution preparation (Sonyeam et al., 2024).

Analysis Note

Assay (GC, area%): ≥ 99.0 % (a/a)
Density (d 20 °C/ 4 °C): 1.003 - 1.005
Water (K. F.): ≤ 0.50 %
Identity (IR): passes test
Due to its specific melting range the product may be solid, liquid, a solidified melt or a supercooled melt.

Informations sur la sécurité

• Classe de stockage: 10 - Combustible liquids
• wgk: WGK 1
• flash_point_f: 226.4 °F - closed cup
• flash_point_c: 108 °C - closed cup