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Ethylidene Glucose extrapure, 90%

CAT: 0565-91018-01Size: 1 gDry Ice: NoHazardous: No
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Description
Part B
CAS Number
13224-99-2
Storage Temperature
8 - 25°C

Chemical Information

4,6-O-Ethylidene-alpha-D-glucopyranose
CAS Number13224-99-2
PubChem CID93075
IUPAC Name(4aR,6S,7R,8R,8aS)-2-methyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine-6,7,8-triol
Molecular FormulaC8H14O6
Molecular Weight206.19
XLogP-1.8
Topological Polar Surface Area88.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Heavy Atom Count14
Formal Charge0
Complexity210
SMILES
CC1OC[C@@H]2[C@@H](O1)[C@@H]([C@H]([C@H](O2)O)O)O
InChI
InChI=1S/C8H14O6/c1-3-12-2-4-7(13-3)5(9)6(10)8(11)14-4/h3-11H,2H2,1H3/t3?,4-,5-,6-,7-,8+/m1/s1
InChIKey
VZPBLPQAMPVTFO-NKWOADHPSA-N
Chemical Structure
2D Structure
2D structure of 4,6-O-Ethylidene-alpha-D-glucopyranose
CAS: 13224-99-2
CID: 93075
Formula: C8H14O6
MW: 206.19
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight206.19
XLogP3-1.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count0
Exact Mass206.07903816
Monoisotopic Mass206.07903816
Topological Polar Surface Area88.4 Ų
Heavy Atom Count14
Formal Charge0
Complexity210
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes