[(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium

C9H6F3NO2RhS — CID 134964459

IUPAC[(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium
SMILESO=S(=O)(/N=C/C(=[Rh])c1ccccc1)C(F)(F)F
InChIInChI=1S/C9H6F3NO2S.Rh/c10-9(11,12)16(14,15)13-7-6-8-4-2-1-3-5-8;/h1-5,7H;/b13-7+;
InChIKeySJAXNIPKWUFXKT-FTPOTTDRSA-N
MW352.12 g/mol
LogP1.67
Rot. Bonds3

About [(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium

[(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium (PubChem CID 134964459) has the molecular formula C9H6F3NO2RhS and a molecular weight of 352.12 g/mol. Its IUPAC name is [(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium.

Molecular Properties

Compound Name[(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium
PubChem CID134964459
Molecular FormulaC9H6F3NO2RhS
Molecular Weight352.12 g/mol
Exact Mass351.91
IUPAC Name[(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium
SMILESO=S(=O)(/N=C/C(=[Rh])c1ccccc1)C(F)(F)F
InChIInChI=1S/C9H6F3NO2S.Rh/c10-9(11,12)16(14,15)13-7-6-8-4-2-1-3-5-8;/h1-5,7H;/b13-7+;
InChIKeySJAXNIPKWUFXKT-FTPOTTDRSA-N
XLogP1.67
TPSA46.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.12
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

[N(E),S(S)]-N-phenylmethyleneperfluorobutanesulfinamide
CID 138395047
[N(E),S(S)]-N-(3-Fluorophenyl)methyleneperfluorobutanesulfinamide
CID 138395053
[N(E),S(S)]-N-(2-Fluorophenyl)methyleneperfluorobutanesulfinamide
CID 138395054
(S)-N-benzylidene-1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfinamide
CID 125477285
(S)-1,1,2,2,3,3,4,4,4-nonafluoro-N-[(2-fluorophenyl)methylidene]butane-1-sulfinamide
CID 125477428
(S)-1,1,2,2,3,3,4,4,4-nonafluoro-N-[(3-fluorophenyl)methylidene]butane-1-sulfinamide
CID 125477454
(NE)-N-[(4-fluorophenyl)methylidene]-2-methylpropane-2-sulfonamide
CID 135035056
(NE)-N-benzylidene-1,1,1-trifluoromethanesulfonamide
CID 13678597
N-(4-Fluorobenzylidene)methanesulfonamide
CID 9581565
N-(4-Trifluoromethylbenzylidene)methanesulfonamide
CID 9581578
Benzylidene(dimethyl)azanium;trifluoromethanesulfonate
CID 11961688
1,1,1-trifluoro-N-methyl-N-[(E)-3-phenylprop-2-enyl]methanesulfonamide
CID 134859388

Frequently Asked Questions

What is the IUPAC name of [(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium?
The IUPAC name of [(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium (CID 134964459) is [(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium.
What is the SMILES notation for [(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium?
The canonical SMILES for [(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium is O=S(=O)(/N=C/C(=[Rh])c1ccccc1)C(F)(F)F.
What is the InChIKey of [(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium?
The InChIKey is SJAXNIPKWUFXKT-FTPOTTDRSA-N. The full InChI is InChI=1S/C9H6F3NO2S.Rh/c10-9(11,12)16(14,15)13-7-6-8-4-2-1-3-5-8;/h1-5,7H;/b13-7+;.
What are the key properties of [(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium?
[(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium has a molecular weight of 352.12 g/mol, XLogP of 1.67, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2E)-1-phenyl-2-(trifluoromethylsulfonylimino)ethylidene]rhodium is sourced from PubChem (CID 134964459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).