Product Name

  • Name

    TRIPENTAERYTHRITOL

  • EINECS 201-097-4
  • CAS No. 78-24-0
  • Article Data10
  • CAS DataBase
  • Density 1.384 g/cm3
  • Solubility
  • Melting Point 225 °C (dec.)(lit.)
  • Formula C15H32O10
  • Boiling Point 670.8 °C at 760 mmHg
  • Molecular Weight 372.413
  • Flash Point 359.5 °C
  • Transport Information
  • Appearance ivory white to beige crystalline powder
  • Safety 24/25
  • Risk Codes
  • Molecular Structure Molecular Structure of 78-24-0 (TRIPENTAERYTHRITOL)
  • Hazard Symbols
  • Synonyms Tripentaerythritol(6CI,8CI);NSC 97579;Tris(pentaerythritol);2,2'-{[2,2-bis(hydroxymethyl)propane-1,3-diyl]bis(oxymethanediyl)}bis[2-(hydroxymethyl)propane-1,3-diol];1,3-Propanediol, 2,2-bis((3-hydroxy-2,2-bis(hydroxymethyl)propoxy)methyl)-;4,8-dioxa-2,2,6,6,10,10-hexahydroxymethylundecane-1,11-diol;
  • PSA 180.30000
  • LogP -4.08280

Synthetic route

formaldehyd
50-00-0

formaldehyd

acetaldehyde
75-07-0

acetaldehyde

tripentaerythritol
78-24-0

tripentaerythritol

Conditions
ConditionsYield
With sodium hydroxide; Pentaerythritol; water at 58℃;
With sodium hydroxide; Pentaerythritol; water at 58℃;
formaldehyd
50-00-0

formaldehyd

acetaldehyde
75-07-0

acetaldehyde

A

Pentaerythritol
115-77-5

Pentaerythritol

B

tri(hydroxymethyl)acetaldehyde
3818-32-4

tri(hydroxymethyl)acetaldehyde

C

Dipentaerythritol
126-58-9

Dipentaerythritol

D

tripentaerythritol
78-24-0

tripentaerythritol

E

3-(3-Hydroxy-2,2-bis-hydroxymethyl-propoxy)-2,2-bis-hydroxymethyl-propionaldehyde

3-(3-Hydroxy-2,2-bis-hydroxymethyl-propoxy)-2,2-bis-hydroxymethyl-propionaldehyde

F

3-[3-(3-Hydroxy-2,2-bis-hydroxymethyl-propoxy)-2,2-bis-hydroxymethyl-propoxy]-2,2-bis-hydroxymethyl-propionaldehyde

3-[3-(3-Hydroxy-2,2-bis-hydroxymethyl-propoxy)-2,2-bis-hydroxymethyl-propoxy]-2,2-bis-hydroxymethyl-propionaldehyde

Conditions
ConditionsYield
With sodium hydroxide at 30℃; Product distribution; Mechanism; pH=12.5; different initial acetaldehyde concentrations;
...Expand
formaldehyd
50-00-0

formaldehyd

acetaldehyde
75-07-0

acetaldehyde

A

tripentaerythritol
78-24-0

tripentaerythritol

B

pentaerythritol and dipentaerythritol

pentaerythritol and dipentaerythritol

Conditions
ConditionsYield
With alkali
With alkali
...Expand
2-bromophenylacetic acid
4870-65-9

2-bromophenylacetic acid

tripentaerythritol
78-24-0

tripentaerythritol

bromo-phenyl-acetic acid 3-(bromo-phenyl-acetoxy)-2-[3-(bromo-phenyl-acetoxy)-2-[3-(bromo-phenyl-acetoxy)-2,2-bis-(bromo-phenyl-acetoxymethyl)-propoxymethyl]-2-(bromo-phenyl-acetoxymethyl)-propoxymethyl]-2-(bromo-phenyl-acetoxymethyl)-propyl ester

bromo-phenyl-acetic acid 3-(bromo-phenyl-acetoxy)-2-[3-(bromo-phenyl-acetoxy)-2-[3-(bromo-phenyl-acetoxy)-2,2-bis-(bromo-phenyl-acetoxymethyl)-propoxymethyl]-2-(bromo-phenyl-acetoxymethyl)-propoxymethyl]-2-(bromo-phenyl-acetoxymethyl)-propyl ester

Conditions
ConditionsYield
With toluene-4-sulfonic acid In toluene at 110℃;100%
tripentaerythritol
78-24-0

tripentaerythritol

cyclohexanone
108-94-1

cyclohexanone

{3-[3-(3-hydroxymethyl-1,5-dioxa-spiro[5.5]undec-3-ylmethoxymethyl)-1,5-dioxa-spiro[5.5]undec-3-ylmethoxymethyl]-1,5-dioxa-spiro[5.5]undec-3-yl}-methanol

{3-[3-(3-hydroxymethyl-1,5-dioxa-spiro[5.5]undec-3-ylmethoxymethyl)-1,5-dioxa-spiro[5.5]undec-3-ylmethoxymethyl]-1,5-dioxa-spiro[5.5]undec-3-yl}-methanol

Conditions
ConditionsYield
With toluene-4-sulfonic acid In N,N-dimethyl-formamide; benzene for 5h; Heating;96%
tripentaerythritol
78-24-0

tripentaerythritol

2-chloro-5,5-dimethyl-[1,3,2]dioxaphosphinane
2428-06-0

2-chloro-5,5-dimethyl-[1,3,2]dioxaphosphinane

octa(5,5-dimethyl-O,O-1,3-propylenephosphite)-2,2-bis(3-hydroxy-2,2-bis-hydroxymethylpropoxymethyl)propane-1,3-diol

octa(5,5-dimethyl-O,O-1,3-propylenephosphite)-2,2-bis(3-hydroxy-2,2-bis-hydroxymethylpropoxymethyl)propane-1,3-diol

Conditions
ConditionsYield
With pyridine In 1,4-dioxane at 20℃; Inert atmosphere;75%
tripentaerythritol
78-24-0

tripentaerythritol

propargyl bromide
106-96-7

propargyl bromide

C39H48O10

C39H48O10

Conditions
ConditionsYield
With sodium hydride In N,N-dimethyl-formamide; toluene; mineral oil at 0 - 50℃; for 48h; Inert atmosphere;65%
2-bromoisobutyric acid bromide
20769-85-1

2-bromoisobutyric acid bromide

tripentaerythritol
78-24-0

tripentaerythritol

(Octa-O-(2-bromo-2-methylpropionyl)-tripentaerythritol)

(Octa-O-(2-bromo-2-methylpropionyl)-tripentaerythritol)

Conditions
ConditionsYield
With pyridine In dichloromethane at 20℃; for 48h; Cooling with ice;61%
With pyridine In dichloromethane at 0 - 20℃; for 48h;45%
Dimethoxymethane
109-87-5

Dimethoxymethane

tripentaerythritol
78-24-0

tripentaerythritol

A

C19H32O10
1186366-70-0

C19H32O10

B

2',2'':6',6'':10',10''-tri-O-methylene-2,2,6,6,10,10-hexakis(hydroxymethyl)-4,8-dioxa-1,11-undecane-diol
84808-77-5

2',2'':6',6'':10',10''-tri-O-methylene-2,2,6,6,10,10-hexakis(hydroxymethyl)-4,8-dioxa-1,11-undecane-diol

Conditions
ConditionsYield
With toluene-4-sulfonic acid for 1.5h; Heating;A 30%
B 55%
...Expand
tripentaerythritol
78-24-0

tripentaerythritol

hexaethylphosphoric triamide
2283-11-6

hexaethylphosphoric triamide

1,7-bis(2',6',7'-trioxa-1'-phosphabicyclo[2.2.2]-octyl-4')-4,4-bishydrohymethyl-2,6-dioxaheptane
68294-31-5

1,7-bis(2',6',7'-trioxa-1'-phosphabicyclo[2.2.2]-octyl-4')-4,4-bishydrohymethyl-2,6-dioxaheptane

Conditions
ConditionsYield
With pyridine at 120 - 125℃; for 24h; Inert atmosphere; regioselective reaction;47%
Dimethoxymethane
109-87-5

Dimethoxymethane

tripentaerythritol
78-24-0

tripentaerythritol

A

C19H32O10
1186366-70-0

C19H32O10

B

C18H32O10
1235861-89-8

C18H32O10

C

2',2'':6',6'':10',10''-tri-O-methylene-2,2,6,6,10,10-hexakis(hydroxymethyl)-4,8-dioxa-1,11-undecane-diol
84808-77-5

2',2'':6',6'':10',10''-tri-O-methylene-2,2,6,6,10,10-hexakis(hydroxymethyl)-4,8-dioxa-1,11-undecane-diol

Conditions
ConditionsYield
With toluene-4-sulfonic acid at 110 - 115℃; for 3.5h;A 33%
B 25%
C 30%
...Expand
tripentaerythritol
78-24-0

tripentaerythritol

benzaldehyde
100-52-7

benzaldehyde

A

{5-[5-(5-hydroxymethyl-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl)-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl]-2-phenyl-[1,3]dioxan-5-yl}-methanol

{5-[5-(5-hydroxymethyl-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl)-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl]-2-phenyl-[1,3]dioxan-5-yl}-methanol

B

{5-[5-(5-hydroxymethyl-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl)-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl]-2-phenyl-[1,3]dioxan-5-yl}-methanol

{5-[5-(5-hydroxymethyl-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl)-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl]-2-phenyl-[1,3]dioxan-5-yl}-methanol

C

{5-[5-(5-hydroxymethyl-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl)-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl]-2-phenyl-[1,3]dioxan-5-yl}-methanol

{5-[5-(5-hydroxymethyl-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl)-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl]-2-phenyl-[1,3]dioxan-5-yl}-methanol

D

{5-[5-(5-hydroxymethyl-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl)-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl]-2-phenyl-[1,3]dioxan-5-yl}-methanol

{5-[5-(5-hydroxymethyl-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl)-2-phenyl-[1,3]dioxan-5-ylmethoxymethyl]-2-phenyl-[1,3]dioxan-5-yl}-methanol

Conditions
ConditionsYield
With toluene-4-sulfonic acid In N,N-dimethyl-formamide; benzene for 12h; Heating;A 16%
B 19%
C 21%
D 22%
...Expand
methyl lactate
547-64-8

methyl lactate

tripentaerythritol
78-24-0

tripentaerythritol

2,18-bis-propionyloxy-6,6,10,10,14,14-hexakis-(2-propionyloxy-propionyloxymethyl)-4,8,12,16-tetraoxa-nonadecane-3,17-dione

2,18-bis-propionyloxy-6,6,10,10,14,14-hexakis-(2-propionyloxy-propionyloxymethyl)-4,8,12,16-tetraoxa-nonadecane-3,17-dione

Conditions
ConditionsYield
With sulfuric acid und Behandeln des Reaktionsprodukts mit Propionsaeure-anhydrid und wenig Schwefelsaeure;
tripentaerythritol
78-24-0

tripentaerythritol

2',2'':6',6'':10',10''-tri-O-methylene-2,2,6,6,10,10-hexakis(hydroxymethyl)-4,8-dioxa-1,11-undecane-diol
84808-77-5

2',2'':6',6'':10',10''-tri-O-methylene-2,2,6,6,10,10-hexakis(hydroxymethyl)-4,8-dioxa-1,11-undecane-diol

Conditions
ConditionsYield
With hydrogenchloride; formaldehyd
formaldehyd
50-00-0

formaldehyd

tripentaerythritol
78-24-0

tripentaerythritol

A

2',2'':6',6'':10',10''-tri-O-methylene-2,2,6,6,10,10-hexakis(hydroxymethyl)-4,8-dioxa-1,11-undecane-diol
84808-77-5

2',2'':6',6'':10',10''-tri-O-methylene-2,2,6,6,10,10-hexakis(hydroxymethyl)-4,8-dioxa-1,11-undecane-diol

B

Tripentaerythrit-diformal
84808-76-4

Tripentaerythrit-diformal

Conditions
ConditionsYield
With hydrogenchloride In water for 3h; Heating;
...Expand
formaldehyd
50-00-0

formaldehyd

tripentaerythritol
78-24-0

tripentaerythritol

A

Tripentaerythrit-monoformal
84808-75-3

Tripentaerythrit-monoformal

B

Tripentaerythrit-diformal
84808-76-4

Tripentaerythrit-diformal

Conditions
ConditionsYield
With hydrogenchloride In water for 3h; Heating;A 34 % Chromat.
B 17 % Chromat.
...Expand
tripentaerythritol
78-24-0

tripentaerythritol

benzaldehyde
100-52-7

benzaldehyde

2-[3-(3-benzyloxy-2,2-bis-hydroxymethyl-propoxy)-2-benzyloxymethyl-2-hydroxymethyl-propoxymethyl]-2-benzyloxymethyl-propane-1,3-diol

2-[3-(3-benzyloxy-2,2-bis-hydroxymethyl-propoxy)-2-benzyloxymethyl-2-hydroxymethyl-propoxymethyl]-2-benzyloxymethyl-propane-1,3-diol

Conditions
ConditionsYield
Stage #1: tripentaerythritol; benzaldehyde With toluene-4-sulfonic acid In N,N-dimethyl-formamide; benzene for 12h; Heating;
Stage #2: With triethylsilane; ethylaluminum dichloride In dichloromethane at -78℃; for 0.666667h;		65 mg
tripentaerythritol
78-24-0

tripentaerythritol

p-toluenesulfonyl chloride
98-59-9

p-toluenesulfonyl chloride

C71H80O26S8

C71H80O26S8

nickel(II) chloride hexahydrate

nickel(II) chloride hexahydrate

Na9[A-α-PW9O34]·7H2O

Na9[A-α-PW9O34]·7H2O

tripentaerythritol
78-24-0

tripentaerythritol

sodium acetate
127-09-3

sodium acetate

ethylenediamine
107-15-3

ethylenediamine

[Ni(en)2(H2O)2][Ni0.5(en)][Ni6(en)3(Ac)2(Tris4)(H2O)2PW9O34]*OH*6H2O

[Ni(en)2(H2O)2][Ni0.5(en)][Ni6(en)3(Ac)2(Tris4)(H2O)2PW9O34]*OH*6H2O

Conditions
ConditionsYield
With acetic acid In water High Pressure; hydrothermal react.; mixt. 1.0 g Na9(PW9O34)*7H2O, 0.8 g NiCl2*6H2O, 0.3ml (NH2CH2)2, 0.2 g tripentaerythritol, 10 ml AcOH/AcONa buffer (pH 4.5 ) stirred for 1 h; heated in Teflon-lined steel autoclave at 170°C for 3 d; cooled to room temp.;
...Expand
tripentaerythritol
78-24-0

tripentaerythritol

methyl β-(3,5-di-tert-butyl-4-hydroxyphenyl)acrylate
27574-90-9

methyl β-(3,5-di-tert-butyl-4-hydroxyphenyl)acrylate

Tripentaerythritol-octakis-<3-(3,5-di-t-butyl-4-hydroxyphenyl)-propionat>
16993-81-0

Tripentaerythritol-octakis-<3-(3,5-di-t-butyl-4-hydroxyphenyl)-propionat>

Conditions
ConditionsYield
With sodium methylate at 100℃; under 4.87549 Torr; for 8h; Reagent/catalyst; Temperature; Time;
tripentaerythritol
78-24-0

tripentaerythritol

3-mercaptopropionic acid
107-96-0

3-mercaptopropionic acid

tripentaerythritol octa(3-mercaptopropionate)

tripentaerythritol octa(3-mercaptopropionate)

Conditions
ConditionsYield
With SO42-/ Al2O3-ZrO2 at 80 - 100℃;537 g
tripentaerythritol
78-24-0

tripentaerythritol

2,4,5-triiodobenzoic acid
35674-21-6

2,4,5-triiodobenzoic acid

C71H40I24O18

C71H40I24O18

Conditions
ConditionsYield
With dmap; dicyclohexyl-carbodiimide In tetrahydrofuran for 12h;
tripentaerythritol
78-24-0

tripentaerythritol

stearic acid
57-11-4

stearic acid

C159H304O18

C159H304O18

Conditions
ConditionsYield
With dmap In tetrahydrofuran for 12h;

1,3-Propanediol,2,2-bis[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]- Specification

The 1,3-Propanediol,2,2-bis[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]-, with the CAS registry number 78-24-0 and EINECS registry number 201-097-4, has the systematic name of 2,2'-{[2,2-bis(hydroxymethyl)propane-1,3-diyl]bis(oxymethanediyl)}bis[2-(hydroxymethyl)propane-1,3-diol]. It is a kind of ivory white to beige crystalline powder, and belongs to the following product categories: Organic Building Blocks; Oxygen Compounds; Polyols. And the molecular formula of the chemical is C15H32O10. What's more, while dealing with this chemical, you should avoid contacting with skin and eyes.

The characteristics of 1,3-Propanediol,2,2-bis[[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]methyl]- are as followings: (1)ACD/LogP: -2.32; (2)# of Rule of 5 Violations: 2; (3)ACD/LogD (pH 5.5): -2.31; (4)ACD/LogD (pH 7.4): -2.31; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.31; (8)ACD/KOC (pH 7.4): 1.31; (9)#H bond acceptors: 10; (10)#H bond donors: 8; (11)#Freely Rotating Bonds: 24; (12)Polar Surface Area: 92.3 Å2; (13)Index of Refraction: 1.561; (14)Molar Refractivity: 87.2 cm3; (15)Molar Volume: 269 cm3; (16)Polarizability: 34.57×10-24cm3; (17)Surface Tension: 73.3 dyne/cm; (18)Density: 1.384 g/cm3; (19)Flash Point: 359.5 °C; (20)Enthalpy of Vaporization: 112.79 kJ/mol; (21)Boiling Point: 670.8 °C at 760 mmHg; (22)Vapour Pressure: 7.28E-21 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: OCC(COCC(COCC(CO)(CO)CO)(CO)CO)(CO)CO
(2)InChI: InChI=1/C15H32O10/c16-1-13(2-17,3-18)9-24-11-15(7-22,8-23)12-25-10-14(4-19,5-20)6-21/h16-23H,1-12H2
(3)InChIKey: PTJWCLYPVFJWMP-UHFFFAOYAS

Related Products

Hot Products

Post buying leads

About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia

Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog

©2008 LookChem.com,License: ICP

NO.:Zhejiang16009103

complaints:service@lookchem.com Desktop View