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CAS RN: 126-30-7 | Product Number: D0791

2,2-Dimethyl-1,3-propanediol


Purity: >98.0%(GC)
Synonyms:
  • 2,2-Bis(hydroxymethyl)propane
  • 2,2-Dihydroxy-2,2-dimethylpropane
  • Neopentyl Glycol
Product Documents:
25G
$18.00
2   2   ≥60 
500G
$30.00
6   4   ≥100 

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Product Number D0791
Purity / Analysis Method >98.0%(GC)
Molecular Formula / Molecular Weight C__5H__1__2O__2 = 104.15 
Physical State (20 deg.C) Solid
Storage Temperature Room Temperature (Recommended in a cool and dark place, <15°C)
Store Under Inert Gas Store under inert gas
Condition to Avoid Hygroscopic
CAS RN 126-30-7
Reaxys Registry Number 605291
PubChem Substance ID 87567416
SDBS (AIST Spectral DB) 2229
Merck Index (14) 6458
MDL Number

MFCD00004685

Specifications
Appearance White to Almost white powder to crystal
Purity(GC) min. 98.0 %
Melting point 127.0 to 130.0 °C
Solubility in Methanol almost transparency
Properties (reference)
Melting Point 128 °C
Boiling Point 210 °C
Solubility in water Soluble
Degree of solubility in water 830 g/l   20 °C
GHS
Pictogram Pictogram
Signal Word Warning
Hazard Statements H315 : Causes skin irritation.
H319 : Causes serious eye irritation.
Precautionary Statements P264 : Wash skin thoroughly after handling.
P280 : Wear protective gloves/ eye protection/ face protection.
P337 + P313 : If eye irritation persists: Get medical advice/ attention.
P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.
P332 + P313 : If skin irritation occurs: Get medical advice/ attention.
P362 : Take off contaminated clothing and wash before reuse.
Related Laws:
RTECS# TY5775000
Transport Information:
HS Number 2905.39.2000
Application
TCI Practical Example: Acetal Protection of an Aldehyde

TCI Practical Example: Acetal Protection of an Aldehyde

Used Chemicals

Procedure

Furfural (1.66 mL, 20 mmol) was dissolved in toluene (30 mL) and then 2,2-dimethyl-1,3-propanediol (2.6 g, 25 mmol) and p-TsOH·H2O (30 mg, 0.17 mmol) were added. A Dean-Stark apparatus was attached and the reaction mixture was stirred for 3 h at reflux temperature. After adding ethyl acetate (50 mL), the organic layer was washed with brine (30 mL). The organic layer was dried with anhydrous sodium sulfate and concentrated under reduced pressure. Purification of the crude product by silica gel chromatography (hexane:ethyl acetate = 10:1) afforded 1 (3.2 g, 88% yield) as a yellow oil.

Experimenter’s Comments

The reaction solution was monitored by UPLC.

Analytical Data

Compound 1

1H NMR (400 MHz, CDCl3); δ 7.45 (m, 1H), 6.46 (m, 1H), 6.37 (m, 1H,), 5.48 (s, 1H), 3.77 (d, J = 10.8 Hz, 2H), 3.64 (d, J = 10.6 Hz, 2H), 1.28 (s, 3H), 0.79 (s, 3H).

Other Reference


PubMed Literature


Product Documents (Note: Some products will not have analytical charts available.)
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