Trimethyl(phenyl)arsanium iodide

CAS Number: 7301-41-9
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C[As+](C)(C)c1ccccc1.[I-]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
I.C9H14As
Molecular Weight
197.132
Drug-likeness
-2.3575
CAS
7301-41-9
InChI key
YWARRRPAVKYXFG-UHFFFAOYSA-M
SMILES
C[As+](C)(C)c1ccccc1.[I-]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 7301-41-9
Molecule Name Trimethyl(phenyl)arsanium iodide
Molecular Formula I.C9H14As
SMILES C[As+](C)(C)c1ccccc1.[I-]
InChI InChI=1S/C9H14As.HI/c1-10(2,3)9-7-5-4-6-8-9;/h4-8H,1-3H3;1H/q+1;/p-1
InChI Key YWARRRPAVKYXFG-UHFFFAOYSA-M
CanonicalSyTyLFy fdee21c03e15a756
TotalMolweight 324.032
Molecular Weight 197.132
MonoisotopicMass 197.031144
CLogP 3.4731
CLogS -2.005
TotalSurfaceArea 123.54
Drug-likeness -2.3575
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions unwanted atom
Shape Index 0.6
Molecula Flexibility 0.50014
Molecular Complexity 0.49698
Fragments 2
Non HAtoms 10
NonCHAtoms 1
Electronegative Atoms 1
Rotatable Bond 1
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 3
Symmetricatoms 4

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