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Ribarate Disodium Salt

CAT: 0572-TRC-R414200-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-R414200-250MGSize:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
13035-93-3
Hazard Statement
No Data Available
Smiles
OC(C(O)C(=O)O[Na])C(O)C(=O)O[Na]
Molecular Formula
C5 H6 Na2 O7
Molecular Weight
224.077
InChI
InChI=1S/C5H8O7.2Na/c6-1(2(7)4(9)10)3(8)5(11)12;;/h1-3,6-8H,(H,9,10)(H,11,12);;/q;2*+1/p-2
Additionnal Information
IUPAC name: (2,3,4-trihydroxy-5-oxo-5-sodiooxypentanoyl)oxysodium
Shipping Conditions
Room Temperature

Chemical Information

Ribarate Disodium Salt
CAS Number13035-93-3
PubChem CID169446152
IUPAC Namedisodium;2,3,4-trihydroxypentanedioate
Molecular FormulaC5H6Na2O7
Molecular Weight224.08
Topological Polar Surface Area141
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Heavy Atom Count14
Formal Charge0
Complexity177
SMILES
C(C(C(=O)[O-])O)(C(C(=O)[O-])O)O.[Na+].[Na+]
InChI
InChI=1S/C5H8O7.2Na/c6-1(2(7)4(9)10)3(8)5(11)12;;/h1-3,6-8H,(H,9,10)(H,11,12);;/q;2*+1/p-2
InChIKey
XWSQGJPHMLUZEL-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Ribarate Disodium Salt
CAS: 13035-93-3
CID: 169446152
Formula: C5H6Na2O7
MW: 224.08
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight224.08
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count4
Exact Mass223.99089109
Monoisotopic Mass223.99089109
Topological Polar Surface Area141 Ų
Heavy Atom Count14
Formal Charge0
Complexity177
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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