Home Other Building Blocks (2S,3R,4S,5S,6R)-2-(2H-1,3-benzodioxol-4-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol

(2S,3R,4S,5S,6R)-2-(2H-1,3-benzodioxol-4-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol

CAS No.:
1955474-56-2
Catalog Number:
AG01B5EE
Molecular Formula:
C13H16O8
Molecular Weight:
300.2613
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01B5EE
Chemical Name:
(2S,3R,4S,5S,6R)-2-(2H-1,3-benzodioxol-4-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol
CAS Number:
1955474-56-2
Molecular Formula:
C13H16O8
Molecular Weight:
300.2613
MDL Number:
MFCD29917139
IUPAC Name:
(2S,3R,4S,5R,6R)-2-(1,3-benzodioxol-4-yloxy)-6-(hydroxymethyl)oxane-3,4,5-triol
InChI:
InChI=1S/C13H16O8/c14-4-8-9(15)10(16)11(17)13(21-8)20-7-3-1-2-6-12(7)19-5-18-6/h1-3,8-11,13-17H,4-5H2/t8-,9+,10+,11-,13-/m1/s1
InChI Key:
UAWKWAYVZIKLGL-VFZGUZRASA-N
SMILES:
OC[C@H]1O[C@@H](Oc2cccc3c2OCO3)[C@@H]([C@H]([C@@H]1O)O)O
Properties
Complexity:
353  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
5  
Defined Bond Stereocenter Count:
0
Exact Mass:
300.085g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
300.263g/mol
Monoisotopic Mass:
300.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties