Triethyl(octyl)arsanium iodide

CAS Number: 26451-95-6
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CCCCCCCC[As+](CC)(CC)CC.[I-]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
I.C14H32As
Molecular Weight
275.33
Drug-likeness
-20.398
CAS
26451-95-6
InChI key
WFZCZTMCSJXGJA-UHFFFAOYSA-M
SMILES
CCCCCCCC[As+](CC)(CC)CC.[I-]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 26451-95-6
Molecule Name Triethyl(octyl)arsanium iodide
Molecular Formula I.C14H32As
SMILES CCCCCCCC[As+](CC)(CC)CC.[I-]
InChI InChI=1S/C14H32As.HI/c1-5-9-10-11-12-13-14-15(6-2,7-3)8-4;/h5-14H2,1-4H3;1H/q+1;/p-1
InChI Key WFZCZTMCSJXGJA-UHFFFAOYSA-M
CanonicalSyTyLFy 5373982b34e35f4d
TotalMolweight 402.23
Molecular Weight 275.33
MonoisotopicMass 275.171994
CLogP 6.5196
CLogS -12.074
TotalSurfaceArea 213.64
Drug-likeness -20.398
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions unwanted atom
Shape Index 0.73333
Molecula Flexibility 0.74579
Molecular Complexity 0.32894
Fragments 2
Non HAtoms 15
NonCHAtoms 1
Electronegative Atoms 1
Rotatable Bond 10
Sp3Atoms 14
Symmetricatoms 4

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