(1E)-N-Cyclohexyl-2-(trimethylsilyl)ethan-1-imine

CAS Number: 53987-08-9
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C[Si](C)(C)C/C=N/C1CCCCC1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
C11H23NSi
Molecular Weight
197.397
Drug-likeness
-70.375
CAS
53987-08-9
InChI key
SMQPFZXNCDZWFB-UHFFFAOYSA-N
SMILES
C[Si](C)(C)C/C=N/C1CCCCC1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 53987-08-9
Molecule Name (1E)-N-Cyclohexyl-2-(trimethylsilyl)ethan-1-imine
Molecular Formula C11H23NSi
SMILES C[Si](C)(C)C/C=N/C1CCCCC1
InChI InChI=1S/C11H23NSi/c1-13(2,3)10-9-12-11-7-5-4-6-8-11/h9,11H,4-8,10H2,1-3H3
InChI Key SMQPFZXNCDZWFB-UHFFFAOYSA-N
CanonicalSyTyLFy e32a3e24220f04c1
TotalMolweight 197.397
Molecular Weight 197.397
MonoisotopicMass 197.159976
CLogP 3.5815
CLogS -4.919
H Acceptors 1
TotalSurfaceArea 170.1
Relative PSA 0.067666
PolarSurfaceArea 12.36
Drug-likeness -70.375
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Nasty Functions imine/hydrazone of aldehyde
Shape Index 0.69231
Molecula Flexibility 0.40611
Molecular Complexity 0.43984
Fragments 1
Non HAtoms 13
NonCHAtoms 2
Electronegative Atoms 1
Rotatable Bond 3
Rings Closures 1
Small Rings 1
Sp3Atoms 10
Symmetricatoms 4
BasicNitrogens 1

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