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Glycolaldehyde dimer

CAT: 0926-FG39432-02Size: 5 gDry Ice: NoHazardous: No
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CAT#:0926-FG39432-02Size:5 g
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CAS Number
23147-58-2
Synonyms
1,4-Dioxane-2,5-diol
MDL Number
MFCD00012133
Smiles
C1C (OCC (O1) O) O
Molecular Formula
C4H8O4
Molecular Weight
120.1 g/mol
Shipping Conditions
Cool Pack
Controlled
No

Chemical Information

Glycolaldehyde dimer

Glycolaldehyde dimer is a member of dioxanes.

CAS Number23147-58-2
PubChem CID186078
IUPAC Name1,4-dioxane-2,5-diol
Molecular FormulaC4H8O4
Molecular Weight120.10
XLogP-1.3
Topological Polar Surface Area58.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity64
SMILES
C1C(OCC(O1)O)O
InChI
InChI=1S/C4H8O4/c5-3-1-7-4(6)2-8-3/h3-6H,1-2H2
InChIKey
ATFVTAOSZBVGHC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Glycolaldehyde dimer
CAS: 23147-58-2
CID: 186078
Formula: C4H8O4
MW: 120.10
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight120.10
XLogP3-1.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass120.04225873
Monoisotopic Mass120.04225873
Topological Polar Surface Area58.9 Ų
Heavy Atom Count8
Formal Charge0
Complexity64.4
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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