Dimethyl[(trimethylsilyl)methyl]sulfanium iodide

CAS Number: 3607-00-9
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C[Si](C)(C)C[S+](C)C.[I-]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
I.C6H17SSi
Molecular Weight
149.353
Drug-likeness
-49.558
CAS
3607-00-9
InChI key
AHEXEDVJCQTVQX-UHFFFAOYSA-M
SMILES
C[Si](C)(C)C[S+](C)C.[I-]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 3607-00-9
Molecule Name Dimethyl[(trimethylsilyl)methyl]sulfanium iodide
Molecular Formula I.C6H17SSi
SMILES C[Si](C)(C)C[S+](C)C.[I-]
InChI InChI=1S/C6H17SSi.HI/c1-7(2)6-8(3,4)5;/h6H2,1-5H3;1H/q+1;/p-1
InChI Key AHEXEDVJCQTVQX-UHFFFAOYSA-M
CanonicalSyTyLFy ebfb503f2f141569
TotalMolweight 276.253
Molecular Weight 149.353
MonoisotopicMass 149.082022
CLogP 2.3691
CLogS -1.964
TotalSurfaceArea 108.81
Drug-likeness -49.558
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Shape Index 0.625
Molecula Flexibility 0.82384
Molecular Complexity 0.53648
Fragments 2
Non HAtoms 8
NonCHAtoms 2
Electronegative Atoms 1
Rotatable Bond 2
Sp3Atoms 7
Symmetricatoms 3

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