formaldehyde;rhenium;dihydroxide;phenoxide

C12H19O9Re2-3 — CID 10009765

IUPACformaldehyde;rhenium;dihydroxide;phenoxide
SMILESC=O.C=O.C=O.C=O.C=O.C=O.[O-]c1ccccc1.[OH-].[OH-].[Re].[Re]
InChIInChI=1S/C6H6O.6CH2O.2H2O.2Re/c7-6-4-2-1-3-5-6;6*1-2;;;;/h1-5,7H;6*1H2;2*1H2;;/p-3
InChIKeyQJMGVXWSINEDHS-UHFFFAOYSA-K
MW679.69 g/mol
LogP-0.71
Rot. Bonds

About formaldehyde;rhenium;dihydroxide;phenoxide

formaldehyde;rhenium;dihydroxide;phenoxide (PubChem CID 10009765) has the molecular formula C12H19O9Re2-3 and a molecular weight of 679.69 g/mol. Its IUPAC name is formaldehyde;rhenium;dihydroxide;phenoxide.

Molecular Properties

Compound Nameformaldehyde;rhenium;dihydroxide;phenoxide
PubChem CID10009765
Molecular FormulaC12H19O9Re2-3
Molecular Weight679.69 g/mol
Exact Mass681.02
IUPAC Nameformaldehyde;rhenium;dihydroxide;phenoxide
SMILESC=O.C=O.C=O.C=O.C=O.C=O.[O-]c1ccccc1.[OH-].[OH-].[Re].[Re]
InChIInChI=1S/C6H6O.6CH2O.2H2O.2Re/c7-6-4-2-1-3-5-6;6*1-2;;;;/h1-5,7H;6*1H2;2*1H2;;/p-3
InChIKeyQJMGVXWSINEDHS-UHFFFAOYSA-K
XLogP-0.71
TPSA185.48 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500679.69
LogP ≤ 5-0.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of formaldehyde;rhenium;dihydroxide;phenoxide?
The IUPAC name of formaldehyde;rhenium;dihydroxide;phenoxide (CID 10009765) is formaldehyde;rhenium;dihydroxide;phenoxide.
What is the SMILES notation for formaldehyde;rhenium;dihydroxide;phenoxide?
The canonical SMILES for formaldehyde;rhenium;dihydroxide;phenoxide is C=O.C=O.C=O.C=O.C=O.C=O.[O-]c1ccccc1.[OH-].[OH-].[Re].[Re].
What is the InChIKey of formaldehyde;rhenium;dihydroxide;phenoxide?
The InChIKey is QJMGVXWSINEDHS-UHFFFAOYSA-K. The full InChI is InChI=1S/C6H6O.6CH2O.2H2O.2Re/c7-6-4-2-1-3-5-6;6*1-2;;;;/h1-5,7H;6*1H2;2*1H2;;/p-3.
What are the key properties of formaldehyde;rhenium;dihydroxide;phenoxide?
formaldehyde;rhenium;dihydroxide;phenoxide has a molecular weight of 679.69 g/mol, XLogP of -0.71, 0 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;rhenium;dihydroxide;phenoxide is sourced from PubChem (CID 10009765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).