carbanide;ethene;formaldehyde;ruthenium(2+)

C4H8ORu — CID 90254555

IUPACcarbanide;ethene;formaldehyde;ruthenium(2+)
SMILESC=O.[CH3-].[H][C-]=C.[Ru+2]
InChIInChI=1S/C2H3.CH2O.CH3.Ru/c2*1-2;;/h1H,2H2;1H2;1H3;/q-1;;-1;+2
InChIKeyQZQCGNOHEPYERU-UHFFFAOYSA-N
MW173.18 g/mol
LogP0.87
Rot. Bonds

About carbanide;ethene;formaldehyde;ruthenium(2+)

carbanide;ethene;formaldehyde;ruthenium(2+) (PubChem CID 90254555) has the molecular formula C4H8ORu and a molecular weight of 173.18 g/mol. Its IUPAC name is carbanide;ethene;formaldehyde;ruthenium(2+).

Molecular Properties

Compound Namecarbanide;ethene;formaldehyde;ruthenium(2+)
PubChem CID90254555
Molecular FormulaC4H8ORu
Molecular Weight173.18 g/mol
Exact Mass173.96
IUPAC Namecarbanide;ethene;formaldehyde;ruthenium(2+)
SMILESC=O.[CH3-].[H][C-]=C.[Ru+2]
InChIInChI=1S/C2H3.CH2O.CH3.Ru/c2*1-2;;/h1H,2H2;1H2;1H3;/q-1;;-1;+2
InChIKeyQZQCGNOHEPYERU-UHFFFAOYSA-N
XLogP0.87
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.18
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbanide;ethene;formaldehyde;ruthenium(2+)?
The IUPAC name of carbanide;ethene;formaldehyde;ruthenium(2+) (CID 90254555) is carbanide;ethene;formaldehyde;ruthenium(2+).
What is the SMILES notation for carbanide;ethene;formaldehyde;ruthenium(2+)?
The canonical SMILES for carbanide;ethene;formaldehyde;ruthenium(2+) is C=O.[CH3-].[H][C-]=C.[Ru+2].
What is the InChIKey of carbanide;ethene;formaldehyde;ruthenium(2+)?
The InChIKey is QZQCGNOHEPYERU-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3.CH2O.CH3.Ru/c2*1-2;;/h1H,2H2;1H2;1H3;/q-1;;-1;+2.
What are the key properties of carbanide;ethene;formaldehyde;ruthenium(2+)?
carbanide;ethene;formaldehyde;ruthenium(2+) has a molecular weight of 173.18 g/mol, XLogP of 0.87, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;ethene;formaldehyde;ruthenium(2+) is sourced from PubChem (CID 90254555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).