formaldehyd
formic acid
acetaldehyde
A
Pentaerythritol
B
Dipentaerythritol
C
sodium formate
Conditions | Yield |
---|---|
Stage #1: formaldehyd; acetaldehyde With sodium hydroxide at 45 - 65℃; under 1500.15 Torr; for 1.38333h; Inert atmosphere; Stage #2: formic acid pH=6; Product distribution / selectivity; | A 87.4% B 5% C 99.7% |
2',2'':6',6''-di-O-benzylidene-2',2'',6',6''-tetra-(hydroxymethyl)-4-oxa-1,7-heptanediol
Dipentaerythritol
Conditions | Yield |
---|---|
With water; acetic acid for 1.5h; Heating; | 88% |
Conditions | Yield |
---|---|
With [1,3]-dioxolan-2-one; tetrabutoxytitanium; boron trioxide; sodium formate at 140 - 190℃; under 412.541 - 727.573 Torr; for 14h; Reagent/catalyst; Pressure; Temperature; Dean-Stark; | 38% |
Conditions | Yield |
---|---|
With alkali Trennung ueber die Salpersaeureester; | |
With alkali Trennung von Pentaerythrit ueber die Salpetersaeureester; | |
With calcium hydroxide; water at 20℃; |
Conditions | Yield |
---|---|
With sodium hydroxide; Pentaerythritol; water at 58℃; |
formaldehyd
acetaldehyde
A
Pentaerythritol
B
tri(hydroxymethyl)acetaldehyde
C
Dipentaerythritol
D
tripentaerythritol
Conditions | Yield |
---|---|
With sodium hydroxide at 30℃; Product distribution; Mechanism; pH=12.5; different initial acetaldehyde concentrations; |
formaldehyd
acetaldehyde
A
Pentaerythritol
B
acetaldol
C
Dipentaerythritol
Conditions | Yield |
---|---|
With sodium hydroxide at 10℃; for 5h; Product distribution; Mechanism; different initial aldehyde concentrations and reaction times; effect of additional pentaerythritol; |
Conditions | Yield |
---|---|
je nach Bedingungen wechselnden Mengen; |
formaldehyd
acetaldehyde
A
Pentaerythritol
B
Formaldehyd-bis(pentaerythrityl)acetal
C
Dipentaerythritol
Conditions | Yield |
---|---|
In water at 10℃; Rate constant; Mechanism; Product distribution; and equilibrium constants; |
Conditions | Yield |
---|---|
at 270℃; Thermolysis; |
Conditions | Yield |
---|---|
With sodium hydroxide; formaldehyd; formic acid In water |
Conditions | Yield |
---|---|
With toluene-4-sulfonic acid In toluene at 110℃; for 6h; | 100% |
With sulfuric acid In toluene for 48h; Heating / reflux; | 58% |
With SO42-/ Al2O3-ZrO2 at 80 - 100℃; | 390.5 g |
Conditions | Yield |
---|---|
With sulfuric acid at 80℃; | 100% |
With toluene-4-sulfonic acid In N,N-dimethyl-formamide; benzene for 6h; Heating; | 98% |
Conditions | Yield |
---|---|
With sulfuric acid; toluene-4-sulfonic acid at 128℃; for 0.15h; Neat (no solvent); Microwave irradiation; | 98% |
2-(hydroxymethyl)-2-methylpropane-1,3-diol
triethyl phosphate
Dipentaerythritol
triethyl phosphite
Conditions | Yield |
---|---|
Stage #1: 2-(hydroxymethyl)-2-methylpropane-1,3-diol; Dipentaerythritol; triethyl phosphite at 85℃; for 5h; Inert atmosphere; Stage #2: triethyl phosphate With Isobutyl bromide at 185℃; for 16h; | 96.1% |
Dipentaerythritol
N,N-diethyl-α,α-difluorobenzylamine
1-phenyl-4-{[(1-phenyl-2,6,7-trioxabicyclo[2.2.2]ocatne-4-yl)methoxy]methyl}-2,6,7-trioxabicyclo[2.2.2]octane
Conditions | Yield |
---|---|
In N,N-dimethyl-formamide at 60℃; for 1h; | 96% |
Conditions | Yield |
---|---|
With sulfuric acid; toluene-4-sulfonic acid at 135℃; for 0.183333h; Neat (no solvent); Microwave irradiation; | 96% |
1,1,1-tri(hydroxymethyl)propane
Dipentaerythritol
dimethyl methane phosphonate
phosphorous acid trimethyl ester
Conditions | Yield |
---|---|
Stage #1: 1,1,1-tri(hydroxymethyl)propane; Dipentaerythritol; phosphorous acid trimethyl ester With phosphoric acid at 85℃; for 5h; Inert atmosphere; Stage #2: dimethyl methane phosphonate With 1-bromo-butane at 185℃; for 16h; | 95.8% |
trimethyl phosphite
1,1,1-tri(hydroxymethyl)propane
tri-n-butyl phosphite
Dipentaerythritol
Conditions | Yield |
---|---|
Stage #1: 1,1,1-tri(hydroxymethyl)propane; tri-n-butyl phosphite; Dipentaerythritol With sulfuric acid at 85℃; for 5h; Inert atmosphere; Stage #2: trimethyl phosphite With 1-Bromopentane at 185℃; for 16h; | 95.6% |
Conditions | Yield |
---|---|
With toluene-4-sulfonic acid In toluene at 110℃; for 16h; | 95% |
Dipentaerythritol
p-toluenesulfonyl chloride
dipentaerythritol hexatosylate
Conditions | Yield |
---|---|
With triethylamine In dichloromethane at 0 - 20℃; Cooling with ice; | 95% |
With pyridine at 25℃; for 48h; | 85% |
With pyridine at 0 - 20℃; | 68% |
Conditions | Yield |
---|---|
With pyridine; <(chlorosulfinyloxy)methylene>dimethylammonium chloride In dichloromethane at 20℃; for 6h; | 94% |
With sulfuric acid; toluene-4-sulfonic acid at 142℃; for 0.166667h; Neat (no solvent); Microwave irradiation; | 90% |
Conditions | Yield |
---|---|
With N,N-dimethyl-formamide In toluene at 80℃; for 0.833333h; Inert atmosphere; | 93.8% |
Conditions | Yield |
---|---|
With pyridine; <(chlorosulfinyloxy)methylene>dimethylammonium chloride In dichloromethane at 20℃; for 6h; | 93% |
Conditions | Yield |
---|---|
With sulfuric acid; toluene-4-sulfonic acid at 115℃; for 0.166667h; Neat (no solvent); Microwave irradiation; | 92% |
Conditions | Yield |
---|---|
With sodium hydride In N,N-dimethyl-formamide; toluene at 0 - 20℃; for 5h; | 91% |
Dipentaerythritol
acetic anhydride
1,2',2'',6',6'',7-hexa-O-acetyl-2',2'',6',6''-tetra-(hydroxymethyl)-4-oxa-heptanediol
Conditions | Yield |
---|---|
With pyridine at 20℃; for 12h; | 90% |
With sodium acetate |
Dipentaerythritol
benzaldehyde
2',2'':6',6''-di-O-benzylidene-2',2'',6',6''-tetra-(hydroxymethyl)-4-oxa-1,7-heptanediol
Conditions | Yield |
---|---|
With hydrogenchloride In dimethyl sulfoxide; N,N-dimethyl-formamide under 100 Torr; for 3h; Heating; | 90% |
With toluene-4-sulfonic acid; benzene Entfernen des entstehenden Wassers; |
Conditions | Yield |
---|---|
With toluene-4-sulfonic acid In toluene at 140℃; for 4h; | 90% |
toluene-4-sulfonic acid In toluene at 140℃; for 3h; |
Dipentaerythritol
2-diethylamino-5,5-dimethyl-1,3,2-dioxaphosphorinane
dipentaerythrite hexa-2,2-dimethyl-1,3-propylene phosphite
Conditions | Yield |
---|---|
With pyridine In 1,4-dioxane at 90 - 100℃; for 2h; | 87% |
Conditions | Yield |
---|---|
With pyridine In 1,4-dioxane | 85% |
Dipentaerythritol
tetrabutylammomium bromide
N,N-dimethyl-formamide
Conditions | Yield |
---|---|
Stage #1: 3H3N*3H(1+)*MnMo6O18(OH)6(3-) In water at 100℃; for 12h; Reflux; Stage #2: Dipentaerythritol for 3h; Reflux; Stage #3: tetrabutylammomium bromide; N,N-dimethyl-formamide | 84% |
Dipentaerythritol
Conditions | Yield |
---|---|
In acetonitrile (OCNHC(CH2OH)3)2 added to MeCN soln. of W complex; refluxed for 6 d in dark, soln. added dropwise to Et2O; ppt. isolated by filtration; dried overnight under vac.; elem. anal.; | 83.8% |
Dipentaerythritol
bis-(3-chloro-2,2-bis-chloromethyl-propyl) ether
Conditions | Yield |
---|---|
With pyridine; thionyl chloride at 50 - 115℃; for 5h; | 82% |
Dipentaerythritol
2-chloro-5,5-dimethyl-[1,3,2]dioxaphosphinane
dipentaerythrite hexa-2,2-dimethyl-1,3-propylene phosphite
Conditions | Yield |
---|---|
With pyridine In 1,4-dioxane | 80% |
Dipentaerythritol
allyl bromide
bis-(3-allyloxy-2,2-bis-allyloxymethyl-propyl)-ether
Conditions | Yield |
---|---|
Stage #1: Dipentaerythritol With sodium hydride In N,N-dimethyl-formamide at 0℃; for 0.333333h; Inert atmosphere; Stage #2: allyl bromide In N,N-dimethyl-formamide at 20℃; for 5h; Inert atmosphere; | 80% |
Conditions | Yield |
---|---|
With triethylamine In N,N-dimethyl-formamide at 55 - 80℃; for 5h; Further stages; | 80% |
With triethylamine In N,N-dimethyl-formamide at 55 - 80℃; for 5h; Temperature; | |
With triethylamine In N,N-dimethyl-formamide at 55 - 80℃; for 5h; Temperature; |
2-bromoisobutyric acid bromide
Dipentaerythritol
Conditions | Yield |
---|---|
With triethylamine In 1,4-dioxane at -18 - 20℃; for 21h; Inert atmosphere; | 76% |
With TEA In tetrahydrofuran | |
With triethylamine In dimethyl sulfoxide at 5 - 20℃; for 48h; | 2.9 g |
With triethylamine In dichloromethane at 0 - 30℃; for 52h; |
formaldehyd
Dipentaerythritol
2',2'':6',6''-di-O-methylidene-2',2'',6',6''-tetra(hydroxymethyl)-4-oxa-1,7-heptanediol
Conditions | Yield |
---|---|
With sulfuric acid In N,N-dimethyl-formamide; benzene at 80℃; | 75% |
With hydrogenchloride at 85℃; for 14h; | 40.6% |
Molecule structure of Dipentaerythritol (CAS NO.126-58-9):
IUPAC Name: 2-[[3-Hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-2-(hydroxymethyl)propane-1,3-diol
Molecular Weight: 254.27748 g/mo
Molecular Formula: C10H22O7
Density: 1.373 g/cm3
Melting Point: 215-218 °C(lit.)
Boiling Point: 542.8 °C at 760 mmHg
Flash Point: 282.1 °C
Index of Refraction: 1.553
Molar Refractivity: 59.26 cm3
Molar Volume: 185 cm3
Surface Tension: 72.5 dyne/cm
Enthalpy of Vaporization: 94.4 kJ/mol
Vapour Pressure: 4.77E-14 mmHg at 25 °C
Water Solubility: 0.29 g/100 mL (20 °C)
Sensitive: hygroscopic
XLogP3-AA: -3.8
H-Bond Donor: 6
H-Bond Acceptor: 7
Rotatable Bond Count: 10
Exact Mass: 254.136553
MonoIsotopic Mass: 254.136553
Topological Polar Surface Area: 131
Heavy Atom Count: 17
Canonical SMILES: C(C(CO)(CO)COCC(CO)(CO)CO)O
InChI: InChI=1S/C10H22O7/c11-1-9(2-12,3-13)7-17-8-10(4-14,5-15)6-16/h11-16H,1-8H2
InChIKey: TXBCBTDQIULDIA-UHFFFAOYSA-N
EINECS: 204-794-1
Product Categories: Organic Building Blocks;Oxygen Compounds;Polyols
Dipentaerythritol (CAS NO.126-58-9) is used in producing polyether, polyester, polyurethane, alkyd resins and photosensitive resin film, etc.
Safety Statements: 24/25
S24/25:Avoid contact with skin and eyes.
WGK Germany: 1
HS Code: 29094919
Dipentaerythritol (CAS NO.126-58-9) is also named as 1,3-Propanediol, 2,2'-(oxybis(methylene))bis(2-(hydroxymethyl)- ; Bis(pentaerythritol) ; Dipentek ; HSDB 5610 ; NSC 65881 ; 2,2,2',2'-Tetrakis(hydroxymethyl)-3,3'-oxydipropan-1-ol . Dipentaerythritol (CAS NO.126-58-9) is white crystalline powder.
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