(1,3-Dithiolane-2,4-diyl)bis(trimethylsilane)

CAS Number: 89291-34-9
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C[Si](C)(C)C1SC([Si](C)(C)C)SC1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
C9H22S2Si2
Molecular Weight
250.578
Drug-likeness
-45.71
CAS
89291-34-9
InChI key
YEAUWGYDYMZRSJ-UHFFFAOYSA-N
SMILES
C[Si](C)(C)C1SC([Si](C)(C)C)SC1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 89291-34-9
Molecule Name (1,3-Dithiolane-2,4-diyl)bis(trimethylsilane)
Molecular Formula C9H22S2Si2
SMILES C[Si](C)(C)C1SC([Si](C)(C)C)SC1
InChI InChI=1S/C9H22S2Si2/c1-12(2,3)8-7-10-9(11-8)13(4,5)6/h8-9H,7H2,1-6H3
InChI Key YEAUWGYDYMZRSJ-UHFFFAOYSA-N
CanonicalSyTyLFy 577eb8ee6b8e9120
TotalMolweight 250.578
Molecular Weight 250.578
MonoisotopicMass 250.070144
CLogP 5.0975
CLogS -1.573
TotalSurfaceArea 174.3
Relative PSA 0.20069
PolarSurfaceArea 50.6
Drug-likeness -45.71
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Shape Index 0.53846
Molecula Flexibility 0.56854
Molecular Complexity 0.59725
Fragments 1
Non HAtoms 13
NonCHAtoms 4
Electronegative Atoms 2
StereoCenters 2
Rotatable Bond 2
Rings Closures 1
Small Rings 1
Sp3Atoms 11
Symmetricatoms 4
StereoCon unknown chirality

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