153214-82-5,MFCD09878500
Catalog No.:AA00AB3T

153214-82-5 | 2,2-Dimethoxypropane-1,3-diol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$50.00   $35.00
- +
1g
98%
in stock  
$122.00   $85.00
- +
10g
98%
in stock  
$615.00   $430.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00AB3T
Chemical Name:
2,2-Dimethoxypropane-1,3-diol
CAS Number:
153214-82-5
Molecular Formula:
C5H12O4
Molecular Weight:
136.1464
MDL Number:
MFCD09878500
SMILES:
OCC(CO)(OC)OC
Properties
Computed Properties
 
Complexity:
63.4  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
-1.5  

Downstream Synthesis Route

[1]TetrahedronAsymmetry,1999,vol.10,p.4017-4028

[2]BioorganicandMedicinalChemistryLetters,1997,vol.7,p.1475-1480

[3]ChineseChemicalLetters,2020,vol.31,p.551-553

[4]Patent:WO2009/129385,2009,A1.Locationinpatent:Page/Pagecolumn78

[5]CarbohydrateResearch,2010,vol.345,p.512-529

[6]Biomacromolecules,2011,vol.12,p.977-986

[1]Wuitschik,Georg;Rogers-Evans,Mark;Mueller,Klaus;Fischer,Holger;Wagner,Bjoern;Schuler,Franz;Polonchuk,Liudmila;Carreira,ErickM.[AngewandteChemie-InternationalEdition,2006,vol.45,#46,p.7736-7739]

Literature

Title: Structure of dihydroxyacetone phosphate dimethyl acetal, a stable dihydroxyacetone phosphate precursor, in the crystalline state.

Journal: Carbohydrate research 20060320

Title: Improved straightforward chemical synthesis of dihydroxyacetone phosphate through enzymatic desymmetrization of 2,2-dimethoxypropane-1,3-diol.

Journal: The Journal of organic chemistry 20041224

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SDS
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Tags:153214-82-5 Molecular Formula|153214-82-5 MDL|153214-82-5 SMILES|153214-82-5 2,2-Dimethoxypropane-1,3-diol
Catalog No.: AA00AB3T
153214-82-5,MFCD09878500
153214-82-5 | 2,2-Dimethoxypropane-1,3-diol
Pack Size: 250mg
Purity: 98%
in stock
$50.00 $35.00
Pack Size: 1g
Purity: 98%
in stock
$122.00 $85.00
Pack Size: 10g
Purity: 98%
in stock
$615.00 $430.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00AB3T
Chemical Name: 2,2-Dimethoxypropane-1,3-diol
CAS Number: 153214-82-5
Molecular Formula: C5H12O4
Molecular Weight: 136.1464
MDL Number: MFCD09878500
SMILES: OCC(CO)(OC)OC
Properties
Complexity: 63.4  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 9  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: -1.5  
Downstream Synthesis Route
96-26-4    149-73-5    153214-82-5 

[1]TetrahedronAsymmetry,1999,vol.10,p.4017-4028

[2]BioorganicandMedicinalChemistryLetters,1997,vol.7,p.1475-1480

[3]ChineseChemicalLetters,2020,vol.31,p.551-553

[4]Patent:WO2009/129385,2009,A1.Locationinpatent:Page/Pagecolumn78

[5]CarbohydrateResearch,2010,vol.345,p.512-529

[6]Biomacromolecules,2011,vol.12,p.977-986

153214-82-5    922500-97-8 

[1]Wuitschik,Georg;Rogers-Evans,Mark;Mueller,Klaus;Fischer,Holger;Wagner,Bjoern;Schuler,Franz;Polonchuk,Liudmila;Carreira,ErickM.[AngewandteChemie-InternationalEdition,2006,vol.45,#46,p.7736-7739]

Literature fold

Title: Structure of dihydroxyacetone phosphate dimethyl acetal, a stable dihydroxyacetone phosphate precursor, in the crystalline state.

Journal: Carbohydrate research20060320

Title: Improved straightforward chemical synthesis of dihydroxyacetone phosphate through enzymatic desymmetrization of 2,2-dimethoxypropane-1,3-diol.

Journal: The Journal of organic chemistry20041224

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