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Oxalic Acid-(1,2-13C2)

CAT: 0572-TRC-O845123-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-O845123-10MGSize:10 mg
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CAS Number
62654-02-8
Synonyms
Ethanedioic Acid-(1,2-13C2); Aktisal-(1,2-13C2); Aquisal-(1,2-13C2); DeerClean-(1,2-13C2); NSC 132055-(1,2-13C2); NSC 151956-(1,2-13C2); NSC 62774-(1,2-13C2); NSC 76990-(1,2-13C2); Ultraplast Activate S 52-(1,2-13C2);
Hazard Statement
Harmful if swallowed
Purity
>95% (HPLC)
Smiles
O=[13C](O)[13C](O)=O
Molecular Formula
13C2H2O4
Molecular Weight
92.02
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Oxalic acid-13C2
CAS Number62654-02-8
PubChem CID16213468
IUPAC Nameoxalic acid
Molecular FormulaC2H2O4
Molecular Weight92.020
XLogP-0.3
Topological Polar Surface Area74.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count6
Formal Charge0
Complexity71
SMILES
[13C](=O)([13C](=O)O)O
InChI
InChI=1S/C2H2O4/c3-1(4)2(5)6/h(H,3,4)(H,5,6)/i1+1,2+1
InChIKey
MUBZPKHOEPUJKR-ZDOIIHCHSA-N
Chemical Structure
2D Structure
2D structure of Oxalic acid-13C2
CAS: 62654-02-8
CID: 16213468
Formula: C2H2O4
MW: 92.020
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight92.020
XLogP3-0.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass92.00201821
Monoisotopic Mass92.00201821
Topological Polar Surface Area74.6 Ų
Heavy Atom Count6
Formal Charge0
Complexity71.5
Isotope Atom Count2
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes