ethanone;bis(rhodium(2+));hydrate

C8H14O5Rh2 — CID 11090502

IUPACethanone;bis(rhodium(2+));hydrate
SMILESC[C-]=O.C[C-]=O.C[C-]=O.C[C-]=O.O.[Rh+2].[Rh+2]
InChIInChI=1S/4C2H3O.H2O.2Rh/c4*1-2-3;;;/h4*1H3;1H2;;/q4*-1;;2*+2
InChIKeyLSCUNNQFUBKYND-UHFFFAOYSA-N
MW396.01 g/mol
LogP-0.37
Rot. Bonds

About ethanone;bis(rhodium(2+));hydrate

ethanone;bis(rhodium(2+));hydrate (PubChem CID 11090502) has the molecular formula C8H14O5Rh2 and a molecular weight of 396.01 g/mol. Its IUPAC name is ethanone;bis(rhodium(2+));hydrate.

Molecular Properties

Compound Nameethanone;bis(rhodium(2+));hydrate
PubChem CID11090502
Molecular FormulaC8H14O5Rh2
Molecular Weight396.01 g/mol
Exact Mass395.90
IUPAC Nameethanone;bis(rhodium(2+));hydrate
SMILESC[C-]=O.C[C-]=O.C[C-]=O.C[C-]=O.O.[Rh+2].[Rh+2]
InChIInChI=1S/4C2H3O.H2O.2Rh/c4*1-2-3;;;/h4*1H3;1H2;;/q4*-1;;2*+2
InChIKeyLSCUNNQFUBKYND-UHFFFAOYSA-N
XLogP-0.37
TPSA99.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.01
LogP ≤ 5-0.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze ethanone;bis(rhodium(2+));hydrate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of ethanone;bis(rhodium(2+));hydrate?
The IUPAC name of ethanone;bis(rhodium(2+));hydrate (CID 11090502) is ethanone;bis(rhodium(2+));hydrate.
What is the SMILES notation for ethanone;bis(rhodium(2+));hydrate?
The canonical SMILES for ethanone;bis(rhodium(2+));hydrate is C[C-]=O.C[C-]=O.C[C-]=O.C[C-]=O.O.[Rh+2].[Rh+2].
What is the InChIKey of ethanone;bis(rhodium(2+));hydrate?
The InChIKey is LSCUNNQFUBKYND-UHFFFAOYSA-N. The full InChI is InChI=1S/4C2H3O.H2O.2Rh/c4*1-2-3;;;/h4*1H3;1H2;;/q4*-1;;2*+2.
What are the key properties of ethanone;bis(rhodium(2+));hydrate?
ethanone;bis(rhodium(2+));hydrate has a molecular weight of 396.01 g/mol, XLogP of -0.37, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethanone;bis(rhodium(2+));hydrate is sourced from PubChem (CID 11090502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).