Ethyl(triphenyl)arsanium iodide

CAS Number: 5424-24-8
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CC[As+](c1ccccc1)(c1ccccc1)c1ccccc1.[I-]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
I.C20H20As
Molecular Weight
335.301
Drug-likeness
-2.4599
CAS
5424-24-8
InChI key
GGCAMLCNQSYMIG-UHFFFAOYSA-M
SMILES
CC[As+](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 5424-24-8
Molecule Name Ethyl(triphenyl)arsanium iodide
Molecular Formula I.C20H20As
SMILES CC[As+](c1ccccc1)(c1ccccc1)c1ccccc1.[I-]
InChI InChI=1S/C20H20As.HI/c1-2-21(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20;/h3-17H,2H2,1H3;1H/q+1;/p-1
InChI Key GGCAMLCNQSYMIG-UHFFFAOYSA-M
CanonicalSyTyLFy 88b4ed8e88985bbc
TotalMolweight 462.201
Molecular Weight 335.301
MonoisotopicMass 335.078094
CLogP 5.0973
CLogS -5.726
TotalSurfaceArea 232.3
Drug-likeness -2.4599
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions unwanted atom
Shape Index 0.42857
Molecula Flexibility 0.47366
Molecular Complexity 0.60487
Fragments 2
Non HAtoms 21
NonCHAtoms 1
Electronegative Atoms 1
Rotatable Bond 4
Rings Closures 3
Small Rings 3
Aromatic Rings 3
Aromatic Atoms 18
Sp3Atoms 2
Symmetricatoms 14

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