(1E)-N-Methyl-3-(trimethylsilyl)prop-2-en-1-imine

CAS Number: 113537-86-3
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C/N=C/C=C[Si](C)(C)C
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
C7H15NSi
Molecular Weight
141.289
Drug-likeness
-47.478
CAS
113537-86-3
InChI key
WUDOSCSPOJPLQI-UHFFFAOYSA-N
SMILES
C/N=C/C=C[Si](C)(C)C
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 113537-86-3
Molecule Name (1E)-N-Methyl-3-(trimethylsilyl)prop-2-en-1-imine
Molecular Formula C7H15NSi
SMILES C/N=C/C=C[Si](C)(C)C
InChI InChI=1S/C7H15NSi/c1-8-6-5-7-9(2,3)4/h5-7H,1-4H3
InChI Key WUDOSCSPOJPLQI-UHFFFAOYSA-N
CanonicalSyTyLFy 8a90f90e935660aa
TotalMolweight 141.289
Molecular Weight 141.289
MonoisotopicMass 141.097376
CLogP 1.8944
CLogS -1.247
H Acceptors 1
TotalSurfaceArea 127.3
Relative PSA 0.090416
PolarSurfaceArea 12.36
Drug-likeness -47.478
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Nasty Functions imine/hydrazone of aldehyde
Shape Index 0.77778
Molecula Flexibility 0.50191
Molecular Complexity 0.40236
Fragments 1
Non HAtoms 9
NonCHAtoms 2
Electronegative Atoms 1
Rotatable Bond 2
Sp3Atoms 4
Symmetricatoms 2
BasicNitrogens 1

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