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Ethylene glycol-d4

CAT: 0804-HY-Y0338S2-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-Y0338S2-01Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Ethylene glycol-d4 is the deuterium labeled Ethylene glycol[1].
CAS Number
2219-51-4
UNSPSC
12352211
Hazard Statement
H303, H315+H320, H332, H335, H336, H370, H373
Target
Endogenous Metabolite
Type
Isotope-Labeled Compounds
Related Pathways
Metabolic Enzyme/Protease
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Others
Purity
99.98
Solubility
DMSO : 100mg/mL (ultrasonic) |H2O : 200 mg/mL (ultrasonic)
Smiles
OC([2H])([2H])C([2H])([2H])O
Molecular Formula
C2H2D4O2
Molecular Weight
66.09
Precautions
H303, H315+H320, H332, H335, H336, H370, H373
References & Citations
[1]Russak EM, et al. Impact of Deuterium Substitution on the Pharmacokinetics of Pharmaceuticals. Ann Pharmacother. 2019 Feb;53 (2) :211-216.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Isotope-Labeled Compounds
Clinical Information
No Development Reported

Chemical Information

1,2-Ethane-1,1,2,2-d4-diol
CAS Number2219-51-4
PubChem CID2733137
IUPAC Name1,1,2,2-tetradeuterioethane-1,2-diol
Molecular FormulaC2H6O2
Molecular Weight66.09
XLogP-1.4
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count4
Formal Charge0
Complexity6
SMILES
[2H]C([2H])(C([2H])([2H])O)O
InChI
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2/i1D2,2D2
InChIKey
LYCAIKOWRPUZTN-LNLMKGTHSA-N
Chemical Structure
2D Structure
2D structure of 1,2-Ethane-1,1,2,2-d4-diol
CAS: 2219-51-4
CID: 2733137
Formula: C2H6O2
MW: 66.09
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight66.09
XLogP3-1.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass66.061886414
Monoisotopic Mass66.061886414
Topological Polar Surface Area40.5 Ų
Heavy Atom Count4
Formal Charge0
Complexity6
Isotope Atom Count4
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
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DE2158Ethylene glycol-D4
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