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Sodium ethyl oxalacetate

CAT: 0931-T34673Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T34673Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
41892-71-1
Target
Others
Related Pathways
Others
Bioactivity
Sodium ethyl oxalacetate can be used in the treatment of hypoglycemia and ketonemia in the ruminant.
Smiles
[Na].CCOC(=O)C(=O)CC(O)=O
Molecular Formula
C6H7NaO5
Molecular Weight
182.11
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Butanedioic acid, 2-oxo-, 1-ethyl ester, sodium salt (1:1)
CAS Number41892-71-1
PubChem CID23674990
IUPAC Namesodium 4-ethoxy-3,4-dioxobutanoate
Molecular FormulaC6H7NaO5
Molecular Weight182.11
Topological Polar Surface Area83.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count12
Formal Charge0
Complexity188
SMILES
CCOC(=O)C(=O)CC(=O)[O-].[Na+]
InChI
InChI=1S/C6H8O5.Na/c1-2-11-6(10)4(7)3-5(8)9;/h2-3H2,1H3,(H,8,9);/q;+1/p-1
InChIKey
LNPFFSPJTLDKKL-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Butanedioic acid, 2-oxo-, 1-ethyl ester, sodium salt (1:1)
CAS: 41892-71-1
CID: 23674990
Formula: C6H7NaO5
MW: 182.11
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight182.11
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass182.01911760
Monoisotopic Mass182.01911760
Topological Polar Surface Area83.5 Ų
Heavy Atom Count12
Formal Charge0
Complexity188
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes