Trimethyl[1-(trimethylsilyl)ethyl]phosphanium iodide

CAS Number: 18359-37-0
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CC([Si](C)(C)C)[P+](C)(C)C.[I-]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
I.C8H22PSi
Molecular Weight
177.323
Drug-likeness
-60.58
CAS
18359-37-0
InChI key
VMPLLDGHUIMMMH-DDWIOCJRSA-M
SMILES
CC([Si](C)(C)C)[P+](C)(C)C.[I-]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 18359-37-0
Molecule Name Trimethyl[1-(trimethylsilyl)ethyl]phosphanium iodide
Molecular Formula I.C8H22PSi
SMILES CC([Si](C)(C)C)[P+](C)(C)C.[I-]
InChI InChI=1S/C8H22PSi.HI/c1-8(9(2,3)4)10(5,6)7;/h8H,1-7H3;1H/q+1;/p-1/t8-;/m1./s1
InChI Key VMPLLDGHUIMMMH-DDWIOCJRSA-M
CanonicalSyTyLFy 52586f18dbabddf8
TotalMolweight 304.223
Molecular Weight 177.323
MonoisotopicMass 177.122839
CLogP 2.9972
CLogS -2.623
TotalSurfaceArea 138.82
Drug-likeness -60.58
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Nasty Functions phosphonium
Shape Index 0.5
Molecula Flexibility 0.81603
Molecular Complexity 0.54931
Fragments 2
Non HAtoms 10
NonCHAtoms 2
Electronegative Atoms 1
StereoCenters 1
Rotatable Bond 2
Sp3Atoms 9
Symmetricatoms 4
StereoCon racemate

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