(16,16-Dichlorohexadecyl)silane

CAS Number: 18551-69-4
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[SiH3]CCCCCCCCCCCCCCCC(Cl)Cl
Molecule Information
Mutagenic: high Tumorigenic: high Irritant: high
Formula
C16H34Cl2Si
Molecular Weight
325.438
Drug-likeness
-12.49
CAS
18551-69-4
InChI key
KZMCXMADAXQGPO-UHFFFAOYSA-N
SMILES
[SiH3]CCCCCCCCCCCCCCCC(Cl)Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
high
Handling Watch
Irritant: high | Reproductive effective: high
PropertyValue
CAS Number 18551-69-4
Molecule Name (16,16-Dichlorohexadecyl)silane
Molecular Formula C16H34Cl2Si
SMILES [SiH3]CCCCCCCCCCCCCCCC(Cl)Cl
InChI InChI=1S/C16H34Cl2Si/c17-16(18)14-12-10-8-6-4-2-1-3-5-7-9-11-13-15-19/h16H,1-15H2,19H3
InChI Key KZMCXMADAXQGPO-UHFFFAOYSA-N
CanonicalSyTyLFy 5692bf0106130dfc
TotalMolweight 325.438
Molecular Weight 325.438
MonoisotopicMass 324.180681
CLogP 7.9414
CLogS -7.489
TotalSurfaceArea 256.49
Drug-likeness -12.49
Mutagenic high
Tumorigenic high
Reproductive Effective high
Irritant high
Shape Index 0.94737
Molecula Flexibility 0.52937
Molecular Complexity 0.36642
Fragments 1
Non HAtoms 19
NonCHAtoms 3
Electronegative Atoms 2
Rotatable Bond 15
Sp3Atoms 16
Symmetricatoms 1

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