(22-Chlorodocosyl)(dimethyl)silane

CAS Number: 59551-81-4
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C[SiH](C)CCCCCCCCCCCCCCCCCCCCCCCl
Molecule Information
Mutagenic: low Tumorigenic: high Irritant: high
Formula
C24H51ClSi
Molecular Weight
403.208
Drug-likeness
-58.836
CAS
59551-81-4
InChI key
YRMXKWKXUZXKKM-UHFFFAOYSA-N
SMILES
C[SiH](C)CCCCCCCCCCCCCCCCCCCCCCCl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
high
Handling Watch
Irritant: high | Reproductive effective: high
PropertyValue
CAS Number 59551-81-4
Molecule Name (22-Chlorodocosyl)(dimethyl)silane
Molecular Formula C24H51ClSi
SMILES C[SiH](C)CCCCCCCCCCCCCCCCCCCCCCCl
InChI InChI=1S/C24H51ClSi/c1-26(2)24-22-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-23-25/h26H,3-24H2,1-2H3
InChI Key YRMXKWKXUZXKKM-UHFFFAOYSA-N
CanonicalSyTyLFy 6b6aa6af6bcc18c8
TotalMolweight 403.208
Molecular Weight 403.208
MonoisotopicMass 402.344854
CLogP 11.659
CLogS -9.192
TotalSurfaceArea 362.91
Drug-likeness -58.836
Mutagenic low
Tumorigenic high
Reproductive Effective high
Irritant high
Shape Index 0.96154
Molecula Flexibility 0.52977
Molecular Complexity 0.42063
Fragments 1
Non HAtoms 26
NonCHAtoms 2
Electronegative Atoms 1
Rotatable Bond 22
Sp3Atoms 24
Symmetricatoms 1

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