(2,2-Dichloroethyl)(2-phenylethyl)silane

CAS Number: 17776-61-3
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ClC(C[SiH2]CCc1ccccc1)Cl
Molecule Information
Mutagenic: high Tumorigenic: high Irritant: high
Formula
C10H14Cl2Si
Molecular Weight
233.213
Drug-likeness
-21.92
CAS
17776-61-3
InChI key
VIXAHZLBZOXDQK-UHFFFAOYSA-N
SMILES
ClC(C[SiH2]CCc1ccccc1)Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
high
Handling Watch
Irritant: high | Reproductive effective: high
PropertyValue
CAS Number 17776-61-3
Molecule Name (2,2-Dichloroethyl)(2-phenylethyl)silane
Molecular Formula C10H14Cl2Si
SMILES ClC(C[SiH2]CCc1ccccc1)Cl
InChI InChI=1S/C10H14Cl2Si/c11-10(12)8-13-7-6-9-4-2-1-3-5-9/h1-5,10H,6-8,13H2
InChI Key VIXAHZLBZOXDQK-UHFFFAOYSA-N
CanonicalSyTyLFy 3d5d718f9af6d38d
TotalMolweight 233.213
Molecular Weight 233.213
MonoisotopicMass 232.024181
CLogP 3.97
CLogS -7.325
TotalSurfaceArea 157.88
Drug-likeness -21.92
Mutagenic high
Tumorigenic high
Reproductive Effective high
Irritant high
Shape Index 0.76923
Molecula Flexibility 0.72953
Molecular Complexity 0.45134
Fragments 1
Non HAtoms 13
NonCHAtoms 3
Electronegative Atoms 2
Rotatable Bond 5
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 4
Symmetricatoms 3

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