(1E)-1-[(Trimethylsilyl)imino]eth-1-ylium

CAS Number: 57088-50-3
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C/[C+]=N/[Si](C)(C)C
Molecule Information
Mutagenic: none Tumorigenic: low Irritant: high
Formula
C5H12NSi
Molecular Weight
114.243
Drug-likeness
-38.405
CAS
57088-50-3
InChI key
GDNREJURIUCLGF-UHFFFAOYSA-N
SMILES
C/[C+]=N/[Si](C)(C)C
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
low
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 57088-50-3
Molecule Name (1E)-1-[(Trimethylsilyl)imino]eth-1-ylium
Molecular Formula C5H12NSi
SMILES C/[C+]=N/[Si](C)(C)C
InChI InChI=1S/C5H12NSi/c1-5-6-7(2,3)4/h1-4H3/q+1
InChI Key GDNREJURIUCLGF-UHFFFAOYSA-N
CanonicalSyTyLFy e06a74ebc2719383
TotalMolweight 114.243
Molecular Weight 114.243
MonoisotopicMass 114.073901
CLogP 2.5787
CLogS -1.212
H Acceptors 1
TotalSurfaceArea 87.55
Relative PSA 0.13147
PolarSurfaceArea 12.36
Drug-likeness -38.405
Mutagenic none
Tumorigenic low
Reproductive Effective none
Irritant high
Nasty Functions carbenium
Shape Index 0.71429
Molecula Flexibility 0.67635
Molecular Complexity 0.4621
Fragments 1
Non HAtoms 7
NonCHAtoms 2
Electronegative Atoms 1
Rotatable Bond 1
Sp3Atoms 4
Symmetricatoms 2
BasicNitrogens 1

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