potassium diisopropylamide

CAS Number: 67459-71-6
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CC(C)[N-]C(C)C.[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.C6H14N
Molecular Weight
100.184
Drug-likeness
-3.705
CAS
67459-71-6
InChI key
ZMJJCODMIXQWCQ-UHFFFAOYSA-N
SMILES
CC(C)[N-]C(C)C.[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 67459-71-6
Molecule Name potassium diisopropylamide
Molecular Formula K.C6H14N
SMILES CC(C)[N-]C(C)C.[K+]
InChI InChI=1S/C6H14N.K/c1-5(2)7-6(3)4;/h5-6H,1-4H3;/q-1;+1
InChI Key ZMJJCODMIXQWCQ-UHFFFAOYSA-N
CanonicalSyTyLFy b9a948aaf0c795f3
TotalMolweight 139.282
Molecular Weight 100.184
MonoisotopicMass 100.112624
CLogP -0.0956
CLogS -1.525
H Acceptors 1
TotalSurfaceArea 87.54
Drug-likeness -3.705
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.71429
Molecula Flexibility 0.80857
Molecular Complexity 0.3662
Fragments 2
Non HAtoms 7
NonCHAtoms 1
Electronegative Atoms 1
Rotatable Bond 2
Sp3Atoms 7
Symmetricatoms 4
Amines 1
AlkylAmines 1
BasicNitrogens 1

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