Potassium stearate

CAS Number: 593-29-3
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CCCCCCCCCCCCCCCCCC([O-])=O.[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.C18H35O2
Molecular Weight
283.474
Drug-likeness
-22.496
CAS
593-29-3
InChI key
ANBFRLKBEIFNQU-UHFFFAOYSA-M
SMILES
CCCCCCCCCCCCCCCCCC([O-])=O.[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 593-29-3
Molecule Name Potassium stearate
Molecular Formula K.C18H35O2
SMILES CCCCCCCCCCCCCCCCCC([O-])=O.[K+]
InChI InChI=1S/C18H36O2.K/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2-17H2,1H3,(H,19,20);/q;+1/p-1
InChI Key ANBFRLKBEIFNQU-UHFFFAOYSA-M
CanonicalSyTyLFy 6bd9b1bd2a5ceb1f
TotalMolweight 322.572
Molecular Weight 283.474
MonoisotopicMass 283.263705
CLogP 4.8953
CLogS -4.779
H Acceptors 2
TotalSurfaceArea 271.2
Relative PSA 0.10074
PolarSurfaceArea 40.13
Drug-likeness -22.496
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.95
Molecula Flexibility 0.52302
Molecular Complexity 0.37701
Fragments 2
Non HAtoms 20
NonCHAtoms 2
Electronegative Atoms 2
Rotatable Bond 16
Sp3Atoms 18
AcidicOxygens 1

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