Potassium 1-(trimethylsilyl)prop-2-en-1-ide

CAS Number: 629663-13-4
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C[Si](C)(C)[CH-]C=C.[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
K.C6H13Si
Molecular Weight
113.255
Drug-likeness
-25.028
CAS
629663-13-4
InChI key
YKDOTEJDCJEUOO-UHFFFAOYSA-N
SMILES
C[Si](C)(C)[CH-]C=C.[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 629663-13-4
Molecule Name Potassium 1-(trimethylsilyl)prop-2-en-1-ide
Molecular Formula K.C6H13Si
SMILES C[Si](C)(C)[CH-]C=C.[K+]
InChI InChI=1S/C6H13Si.K/c1-5-6-7(2,3)4;/h5-6H,1H2,2-4H3;/q-1;+1
InChI Key YKDOTEJDCJEUOO-UHFFFAOYSA-N
CanonicalSyTyLFy a033aeb6a1d6abd9
TotalMolweight 152.353
Molecular Weight 113.255
MonoisotopicMass 113.078652
CLogP 2.8476
CLogS -3.79
TotalSurfaceArea 88.32
Drug-likeness -25.028
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Shape Index 0.71429
Molecula Flexibility 0.72115
Molecular Complexity 0.4621
Fragments 2
Non HAtoms 7
NonCHAtoms 1
Rotatable Bond 2
Sp3Atoms 4
Symmetricatoms 2

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