benzene-1,3-dicarboxylic acid;bis(oxovanadium)

C8H6O6V2 — CID 175058982

IUPACbenzene-1,3-dicarboxylic acid;bis(oxovanadium)
SMILESO=C(O)c1cccc(C(=O)O)c1.O=[V].O=[V]
InChIInChI=1S/C8H6O4.2O.2V/c9-7(10)5-2-1-3-6(4-5)8(11)12;;;;/h1-4H,(H,9,10)(H,11,12);;;;
InChIKeyLFYFZJRHJKHFOZ-UHFFFAOYSA-N
MW300.02 g/mol
LogP0.84
Rot. Bonds2

About benzene-1,3-dicarboxylic acid;bis(oxovanadium)

benzene-1,3-dicarboxylic acid;bis(oxovanadium) (PubChem CID 175058982) has the molecular formula C8H6O6V2 and a molecular weight of 300.02 g/mol. Its IUPAC name is benzene-1,3-dicarboxylic acid;bis(oxovanadium).

Molecular Properties

Compound Namebenzene-1,3-dicarboxylic acid;bis(oxovanadium)
PubChem CID175058982
Molecular FormulaC8H6O6V2
Molecular Weight300.02 g/mol
Exact Mass299.90
IUPAC Namebenzene-1,3-dicarboxylic acid;bis(oxovanadium)
SMILESO=C(O)c1cccc(C(=O)O)c1.O=[V].O=[V]
InChIInChI=1S/C8H6O4.2O.2V/c9-7(10)5-2-1-3-6(4-5)8(11)12;;;;/h1-4H,(H,9,10)(H,11,12);;;;
InChIKeyLFYFZJRHJKHFOZ-UHFFFAOYSA-N
XLogP0.84
TPSA108.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.02
LogP ≤ 50.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 22957310
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Frequently Asked Questions

What is the IUPAC name of benzene-1,3-dicarboxylic acid;bis(oxovanadium)?
The IUPAC name of benzene-1,3-dicarboxylic acid;bis(oxovanadium) (CID 175058982) is benzene-1,3-dicarboxylic acid;bis(oxovanadium).
What is the SMILES notation for benzene-1,3-dicarboxylic acid;bis(oxovanadium)?
The canonical SMILES for benzene-1,3-dicarboxylic acid;bis(oxovanadium) is O=C(O)c1cccc(C(=O)O)c1.O=[V].O=[V].
What is the InChIKey of benzene-1,3-dicarboxylic acid;bis(oxovanadium)?
The InChIKey is LFYFZJRHJKHFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6O4.2O.2V/c9-7(10)5-2-1-3-6(4-5)8(11)12;;;;/h1-4H,(H,9,10)(H,11,12);;;;.
What are the key properties of benzene-1,3-dicarboxylic acid;bis(oxovanadium)?
benzene-1,3-dicarboxylic acid;bis(oxovanadium) has a molecular weight of 300.02 g/mol, XLogP of 0.84, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for benzene-1,3-dicarboxylic acid;bis(oxovanadium) is sourced from PubChem (CID 175058982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).