(2-Chloroethyl)(3-phenylpropyl)silane

CAS Number: 18106-32-6
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ClCC[SiH2]CCCc1ccccc1
Molecule Information
Mutagenic: low Tumorigenic: high Irritant: high
Formula
C11H17ClSi
Molecular Weight
212.795
Drug-likeness
-23.586
CAS
18106-32-6
InChI key
CXHNMIGGQYIMQV-UHFFFAOYSA-N
SMILES
ClCC[SiH2]CCCc1ccccc1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
high
Handling Watch
Irritant: high | Reproductive effective: high
PropertyValue
CAS Number 18106-32-6
Molecule Name (2-Chloroethyl)(3-phenylpropyl)silane
Molecular Formula C11H17ClSi
SMILES ClCC[SiH2]CCCc1ccccc1
InChI InChI=1S/C11H17ClSi/c12-8-10-13-9-4-7-11-5-2-1-3-6-11/h1-3,5-6H,4,7-10,13H2
InChI Key CXHNMIGGQYIMQV-UHFFFAOYSA-N
CanonicalSyTyLFy 453c9c5468909f9d
TotalMolweight 212.795
Molecular Weight 212.795
MonoisotopicMass 212.078804
CLogP 4.0222
CLogS -7.298
TotalSurfaceArea 157.48
Drug-likeness -23.586
Mutagenic low
Tumorigenic high
Reproductive Effective high
Irritant high
Shape Index 0.84615
Molecula Flexibility 0.70931
Molecular Complexity 0.43984
Fragments 1
Non HAtoms 13
NonCHAtoms 2
Electronegative Atoms 1
Rotatable Bond 6
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 5
Symmetricatoms 2

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