benzene-1,2-diol;vanadium(2+)

C6H6O2V+2 — CID 159711752

IUPACbenzene-1,2-diol;vanadium(2+)
SMILESOc1ccccc1O.[V+2]
InChIInChI=1S/C6H6O2.V/c7-5-3-1-2-4-6(5)8;/h1-4,7-8H;/q;+2
InChIKeyMYXSLNBGFCYJKZ-UHFFFAOYSA-N
MW161.06 g/mol
LogP1.10
Rot. Bonds

About benzene-1,2-diol;vanadium(2+)

benzene-1,2-diol;vanadium(2+) (PubChem CID 159711752) has the molecular formula C6H6O2V+2 and a molecular weight of 161.06 g/mol. Its IUPAC name is benzene-1,2-diol;vanadium(2+).

Molecular Properties

Compound Namebenzene-1,2-diol;vanadium(2+)
PubChem CID159711752
Molecular FormulaC6H6O2V+2
Molecular Weight161.06 g/mol
Exact Mass160.98
IUPAC Namebenzene-1,2-diol;vanadium(2+)
SMILESOc1ccccc1O.[V+2]
InChIInChI=1S/C6H6O2.V/c7-5-3-1-2-4-6(5)8;/h1-4,7-8H;/q;+2
InChIKeyMYXSLNBGFCYJKZ-UHFFFAOYSA-N
XLogP1.10
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.06
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol_A(92)', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of benzene-1,2-diol;vanadium(2+)?
The IUPAC name of benzene-1,2-diol;vanadium(2+) (CID 159711752) is benzene-1,2-diol;vanadium(2+).
What is the SMILES notation for benzene-1,2-diol;vanadium(2+)?
The canonical SMILES for benzene-1,2-diol;vanadium(2+) is Oc1ccccc1O.[V+2].
What is the InChIKey of benzene-1,2-diol;vanadium(2+)?
The InChIKey is MYXSLNBGFCYJKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6O2.V/c7-5-3-1-2-4-6(5)8;/h1-4,7-8H;/q;+2.
What are the key properties of benzene-1,2-diol;vanadium(2+)?
benzene-1,2-diol;vanadium(2+) has a molecular weight of 161.06 g/mol, XLogP of 1.10, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzene-1,2-diol;vanadium(2+) is sourced from PubChem (CID 159711752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).