Tetraphenylstibanium iodide

CAS Number: 16894-70-5
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c(cc1)ccc1[Sb+](c1ccccc1)(c1ccccc1)c1ccccc1.[I-]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
I.C24H20Sb
Molecular Weight
430.183
Drug-likeness
-2.3575
CAS
16894-70-5
InChI key
RTIPRBMUMNKBRW-UHFFFAOYSA-M
SMILES
c(cc1)ccc1[Sb+](c1ccccc1)(c1ccccc1)c1ccccc1.[I-]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 16894-70-5
Molecule Name Tetraphenylstibanium iodide
Molecular Formula I.C24H20Sb
SMILES c(cc1)ccc1[Sb+](c1ccccc1)(c1ccccc1)c1ccccc1.[I-]
InChI InChI=1S/4C6H5.HI.Sb/c4*1-2-4-6-5-3-1;;/h4*1-5H;1H;/q;;;;;+1/p-1
InChI Key RTIPRBMUMNKBRW-UHFFFAOYSA-M
CanonicalSyTyLFy e6581a8669d231a2
TotalMolweight 557.083
Molecular Weight 430.183
MonoisotopicMass 429.060321
CLogP 5.532
CLogS -4.15
TotalSurfaceArea 266.04
Drug-likeness -2.3575
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions unwanted atom
Shape Index 0.36
Molecula Flexibility 0.41725
Molecular Complexity 0.58251
Fragments 2
Non HAtoms 25
NonCHAtoms 1
Metal Atoms 1
Rotatable Bond 4
Rings Closures 4
Small Rings 4
Aromatic Rings 4
Aromatic Atoms 24
Symmetricatoms 20

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