Home Other Building Blocks 1,3-Dihydroxypropan-2-one dimer

1,3-Dihydroxypropan-2-one dimer

CAS No.:
26776-70-5
Catalog Number:
AG003DJY
Molecular Formula:
C6H12O6
Molecular Weight:
180.1559
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
>96.0%(T)
1 week
United States
$66
- +
100g
>96.0%(T)
1 week
United States
$103
- +
500g
>96.0%(T)
1 week
United States
$262
- +
Product Description
Catalog Number:
AG003DJY
Chemical Name:
1,3-Dihydroxypropan-2-one dimer
CAS Number:
26776-70-5
Molecular Formula:
C6H12O6
Molecular Weight:
180.1559
MDL Number:
MFCD00051019
IUPAC Name:
2,5-bis(hydroxymethyl)-1,4-dioxane-2,5-diol
InChI:
InChI=1S/C6H12O6/c7-1-5(9)3-12-6(10,2-8)4-11-5/h7-10H,1-4H2
InChI Key:
KEQUNHIAUQQPAC-UHFFFAOYSA-N
SMILES:
OCC1(O)OCC(OC1)(O)CO
EC Number:
612-947-2
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.063g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
180.156g/mol
Monoisotopic Mass:
180.063g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
99.4A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
-3.1  
Properties