(1,4-Phenylene)bis(trichlorosilane)

CAS Number: 830-46-6
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Cl[Si](c(cc1)ccc1[Si](Cl)(Cl)Cl)(Cl)Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
C6H4Cl6Si2
Molecular Weight
344.988
Drug-likeness
-37.648
CAS
830-46-6
InChI key
OPFQVUPHZIFJLS-UHFFFAOYSA-N
SMILES
Cl[Si](c(cc1)ccc1[Si](Cl)(Cl)Cl)(Cl)Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 830-46-6
Molecule Name (1,4-Phenylene)bis(trichlorosilane)
Molecular Formula C6H4Cl6Si2
SMILES Cl[Si](c(cc1)ccc1[Si](Cl)(Cl)Cl)(Cl)Cl
InChI InChI=1S/C6H4Cl6Si2/c7-13(8,9)5-1-2-6(4-3-5)14(10,11)12/h1-4H
InChI Key OPFQVUPHZIFJLS-UHFFFAOYSA-N
CanonicalSyTyLFy 3cd90756db11f5c4
TotalMolweight 344.988
Molecular Weight 344.988
MonoisotopicMass 341.798266
CLogP 1.1064
CLogS -5.46
TotalSurfaceArea 192.78
Drug-likeness -37.648
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Shape Index 0.57143
Molecula Flexibility 0.57074
Molecular Complexity 0.55303
Fragments 1
Non HAtoms 14
NonCHAtoms 8
Electronegative Atoms 6
Rotatable Bond 2
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Symmetricatoms 10

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