Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

1,3-Propanediol,2-(hydroxymethyl)-2-propyl-

Related Products

Hot Products

Name

1,3-Propanediol,2-(hydroxymethyl)-2-propyl-

EINECS 231-065-5
CAS No. 7426-71-3 Density 1.084 g/cm3
PSA 60.69000 LogP -0.25020
Solubility N/A Melting Point N/A
Formula C7H16O3 Boiling Point 306.8 °C at 760 mmHg
Molecular Weight 148.202 Flash Point 151.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 7426-71-3 (butylidynetrimethanol) Hazard Symbols N/A
Synonyms

Butylidynetrimethanol;

Article Data 10

1,3-Propanediol,2-(hydroxymethyl)-2-propyl- Synthetic route

50-00-0

formaldehyd

110-62-3

pentanal

7426-71-3

2-(hydroxymethyl)-2-propylpropane-1,3-diol

Conditions
ConditionsYield
With sodium hydroxide In acetonitrile at 60 - 80℃; for 1h;52%
With potassium hydroxide In ethanol; water at 50℃; Cooling with ice;10%
(i) NaOH, (ii) nBuOH, (heating); Multistep reaction;
With sodium hydroxide In acetonitrile
With sodium hydroxide In acetonitrile at 20 - 80℃; for 0.833333h; Inert atmosphere;6.6 g
50-00-0

formaldehyd

142-96-1

dibutyl ether

7426-71-3

2-(hydroxymethyl)-2-propylpropane-1,3-diol

Conditions
ConditionsYield
Irradiation.mit UV-Licht;
50-00-0

formaldehyd

142-96-1

dibutyl ether

A

7426-71-3

2-(hydroxymethyl)-2-propylpropane-1,3-diol

B

2612-28-4

2-propyl-propane-1,3-diol

Conditions
ConditionsYield
Irradiation.mit UV-Licht;
anschliessend Betrahlen der Reaktionsloesung mit UV;
14274-62-5

2-n-propyl-2-hydroxymethyl-propan-1,3-diol triacetate

7426-71-3

2-(hydroxymethyl)-2-propylpropane-1,3-diol

Conditions
ConditionsYield
With sodium In methanol

C7H13O3(3-)*Sb(3+)

7426-71-3

2-(hydroxymethyl)-2-propylpropane-1,3-diol

Conditions
ConditionsYield
With water-d2 In dimethylsulfoxide-d6 Glovebox;
7426-71-3

2-(hydroxymethyl)-2-propylpropane-1,3-diol

antimony(III) tert-butoxide

C7H13O3(3-)*Sb(3+)

Conditions
ConditionsYield
In tetrahydrofuran at 22℃; Inert atmosphere; Sealed tube;70.4%
7426-71-3

2-(hydroxymethyl)-2-propylpropane-1,3-diol

107829-94-7

3-hydroxymethyl-3-n-propyl oxetane

Conditions
ConditionsYield
With potassium carbonate; Diethyl carbonate at 125℃; for 3h;38%
With potassium carbonate; Diethyl carbonate at 125℃; for 6h; Inert atmosphere;3.7 g
7426-71-3

2-(hydroxymethyl)-2-propylpropane-1,3-diol

56823-74-6

methyl 5-t-butyl-2,3-dimethyl-4-hydroxyphenylacetate

56823-89-3

(5-tert-Butyl-4-hydroxy-2,3-dimethyl-phenyl)-acetic acid 2,2-bis-[2-(5-tert-butyl-4-hydroxy-2,3-dimethyl-phenyl)-acetoxymethyl]-pentyl ester

Conditions
ConditionsYield
With lithium hydride
7426-71-3

2-(hydroxymethyl)-2-propylpropane-1,3-diol

13722-71-9

1-chloro-2,2-bis-chloromethyl-pentane

Conditions
ConditionsYield
With pyridine; thionyl chloride
7426-71-3

2-(hydroxymethyl)-2-propylpropane-1,3-diol

18644-16-1

4-n-propyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane

1,3-Propanediol,2-(hydroxymethyl)-2-propyl- Specification

The 1,3-Propanediol,2-(hydroxymethyl)-2-propyl-, with the CAS registry number 7426-71-3, is also known as Butylidynetrimethanol. Its EINECS registry number is 231-065-5. This chemical's molecular formula is C7H16O3 and molecular weight is 148.2001. What's more, both its IUPAC name and systematic name are the same which is 2-(Hydroxymethyl)-2-propylpropane-1,3-diol. 

Physical properties about 1,3-Propanediol,2-(hydroxymethyl)-2-propyl- are: (1)ACD/LogP: -0.32; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.32; (4)ACD/LogD (pH 7.4): -0.32; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 15.92; (8)ACD/KOC (pH 7.4): 15.92; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 27.69 Å2; (13)Index of Refraction: 1.483; (14)Molar Refractivity: 39.04 cm3; (15)Molar Volume: 136.6 cm3; (16)Polarizability: 15.48×10-24 cm3; (17)Surface Tension: 46 dyne/cm; (18)Density: 1.084 g/cm3; (19)Flash Point: 151.2 °C; (20)Enthalpy of Vaporization: 63.48 kJ/mol; (21)Boiling Point: 306.8 °C at 760 mmHg; (22)Vapour Pressure: 6.98E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: OCC(CCC)(CO)CO
(2) InChI: InChI=1/C7H16O3/c1-2-3-7(4-8,5-9)6-10/h8-10H,2-6H2,1H3
(3) InChIKey: SZSSMFVYZRQGIM-UHFFFAOYAE

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 7426-71-3