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Home Other Building Blocks 2,2-Dimethoxypropane-1,3-diol

2,2-Dimethoxypropane-1,3-diol

CAS No.:
153214-82-5
Catalog Number:
AG00AB6L
Molecular Formula:
C5H12O4
Molecular Weight:
136.1464
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$73
- +
1g
98%
1 week
United States
$142
- +
10g
98%
1 week
United States
$621
- +
Product Description
Catalog Number:
AG00AB6L
Chemical Name:
2,2-Dimethoxypropane-1,3-diol
CAS Number:
153214-82-5
Molecular Formula:
C5H12O4
Molecular Weight:
136.1464
MDL Number:
MFCD09878500
IUPAC Name:
2,2-dimethoxypropane-1,3-diol
InChI:
InChI=1S/C5H12O4/c1-8-5(3-6,4-7)9-2/h6-7H,3-4H2,1-2H3
InChI Key:
HYRZFKCRTXTLLZ-UHFFFAOYSA-N
SMILES:
OCC(CO)(OC)OC
Properties
Complexity:
63.4  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.074g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
136.147g/mol
Monoisotopic Mass:
136.074g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5  
Literature
Title Journal
Structure of dihydroxyacetone phosphate dimethyl acetal, a stable dihydroxyacetone phosphate precursor, in the crystalline state. Carbohydrate research 20060320
Improved straightforward chemical synthesis of dihydroxyacetone phosphate through enzymatic desymmetrization of 2,2-dimethoxypropane-1,3-diol. The Journal of organic chemistry 20041224
Properties