rhodium;3,4,5-triphenylfuran-5-id-2-one

C22H15O2Rh- — CID 162398279

IUPACrhodium;3,4,5-triphenylfuran-5-id-2-one
SMILESO=c1o[c-](-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1.[Rh]
InChIInChI=1S/C22H15O2.Rh/c23-22-20(17-12-6-2-7-13-17)19(16-10-4-1-5-11-16)21(24-22)18-14-8-3-9-15-18;/h1-15H;/q-1;
InChIKeyYBOAHDWGBKFDTR-UHFFFAOYSA-N
MW414.27 g/mol
LogP5.36
Rot. Bonds3

About rhodium;3,4,5-triphenylfuran-5-id-2-one

rhodium;3,4,5-triphenylfuran-5-id-2-one (PubChem CID 162398279) has the molecular formula C22H15O2Rh- and a molecular weight of 414.27 g/mol. Its IUPAC name is rhodium;3,4,5-triphenylfuran-5-id-2-one.

Molecular Properties

Compound Namerhodium;3,4,5-triphenylfuran-5-id-2-one
PubChem CID162398279
Molecular FormulaC22H15O2Rh-
Molecular Weight414.27 g/mol
Exact Mass414.01
IUPAC Namerhodium;3,4,5-triphenylfuran-5-id-2-one
SMILESO=c1o[c-](-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1.[Rh]
InChIInChI=1S/C22H15O2.Rh/c23-22-20(17-12-6-2-7-13-17)19(16-10-4-1-5-11-16)21(24-22)18-14-8-3-9-15-18;/h1-15H;/q-1;
InChIKeyYBOAHDWGBKFDTR-UHFFFAOYSA-N
XLogP5.36
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.27
LogP ≤ 55.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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2,6-bis(hydroxymethyl)-3,5-diphenylpyran-4-one
CID 12006528
8-phenyl-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),8-triene-4,12-dione
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CID 56632747
6-methyl-4,5-diphenylpyran-2-one
CID 71359580
4-bromo-3,6-diphenylpyran-2-one
CID 100914705
tris(2,3,4,5,6-pentakis-phenylphenyl)alumane
CID 177448020
benzene;tris(1,1'-biphenyl)
CID 162155747
3-benzoyl-4-phenylchromen-2-one
CID 629843
3-bromo-2,4-diphenyl-1,2-oxazol-5-one
CID 2750874
4-phenyl-3-propan-2-ylisochromen-1-one
CID 123749566

Frequently Asked Questions

What is the IUPAC name of rhodium;3,4,5-triphenylfuran-5-id-2-one?
The IUPAC name of rhodium;3,4,5-triphenylfuran-5-id-2-one (CID 162398279) is rhodium;3,4,5-triphenylfuran-5-id-2-one.
What is the SMILES notation for rhodium;3,4,5-triphenylfuran-5-id-2-one?
The canonical SMILES for rhodium;3,4,5-triphenylfuran-5-id-2-one is O=c1o[c-](-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1.[Rh].
What is the InChIKey of rhodium;3,4,5-triphenylfuran-5-id-2-one?
The InChIKey is YBOAHDWGBKFDTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15O2.Rh/c23-22-20(17-12-6-2-7-13-17)19(16-10-4-1-5-11-16)21(24-22)18-14-8-3-9-15-18;/h1-15H;/q-1;.
What are the key properties of rhodium;3,4,5-triphenylfuran-5-id-2-one?
rhodium;3,4,5-triphenylfuran-5-id-2-one has a molecular weight of 414.27 g/mol, XLogP of 5.36, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for rhodium;3,4,5-triphenylfuran-5-id-2-one is sourced from PubChem (CID 162398279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).