oxalic acid;thorium

C4H4O8Th — CID 25199595

IUPACoxalic acid;thorium
SMILESO=C(O)C(=O)O.O=C(O)C(=O)O.[Th]
InChIInChI=1S/2C2H2O4.Th/c2*3-1(4)2(5)6;/h2*(H,3,4)(H,5,6);
InChIKeyMVVXFNGAKVVFBW-UHFFFAOYSA-N
MW412.11 g/mol
LogP-1.69
Rot. Bonds

About oxalic acid;thorium

oxalic acid;thorium (PubChem CID 25199595) has the molecular formula C4H4O8Th and a molecular weight of 412.11 g/mol. Its IUPAC name is oxalic acid;thorium.

Molecular Properties

Compound Nameoxalic acid;thorium
PubChem CID25199595
Molecular FormulaC4H4O8Th
Molecular Weight412.11 g/mol
Exact Mass412.03
IUPAC Nameoxalic acid;thorium
SMILESO=C(O)C(=O)O.O=C(O)C(=O)O.[Th]
InChIInChI=1S/2C2H2O4.Th/c2*3-1(4)2(5)6;/h2*(H,3,4)(H,5,6);
InChIKeyMVVXFNGAKVVFBW-UHFFFAOYSA-N
XLogP-1.69
TPSA149.20 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.11
LogP ≤ 5-1.69
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Related Compounds

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CID 90472147
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CID 91886498
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CID 173039711
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CID 71311498
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Frequently Asked Questions

What is the IUPAC name of oxalic acid;thorium?
The IUPAC name of oxalic acid;thorium (CID 25199595) is oxalic acid;thorium.
What is the SMILES notation for oxalic acid;thorium?
The canonical SMILES for oxalic acid;thorium is O=C(O)C(=O)O.O=C(O)C(=O)O.[Th].
What is the InChIKey of oxalic acid;thorium?
The InChIKey is MVVXFNGAKVVFBW-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H2O4.Th/c2*3-1(4)2(5)6;/h2*(H,3,4)(H,5,6);.
What are the key properties of oxalic acid;thorium?
oxalic acid;thorium has a molecular weight of 412.11 g/mol, XLogP of -1.69, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxalic acid;thorium is sourced from PubChem (CID 25199595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).