(2,2-Dimethylpropoxy)(triethyl)plumbane

CAS Number: 17393-68-9
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CC[Pb](CC)(CC)OCC(C)(C)C
Molecule Information
Mutagenic: low Tumorigenic: low Irritant: none
Formula
C11H26OPb
Molecular Weight
381.526
Drug-likeness
-11.637
CAS
17393-68-9
InChI key
KBXLGHRWRLTSKY-UHFFFAOYSA-N
SMILES
CC[Pb](CC)(CC)OCC(C)(C)C
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
low
Handling Watch
Irritant: none | Reproductive effective: low
PropertyValue
CAS Number 17393-68-9
Molecule Name (2,2-Dimethylpropoxy)(triethyl)plumbane
Molecular Formula C11H26OPb
SMILES CC[Pb](CC)(CC)OCC(C)(C)C
InChI InChI=1S/C5H11O.3C2H5.Pb/c1-5(2,3)4-6;3*1-2;/h4H2,1-3H3;3*1H2,2H3;/q-1;;;;+1
InChI Key KBXLGHRWRLTSKY-UHFFFAOYSA-N
CanonicalSyTyLFy c3599be81a79a322
TotalMolweight 381.526
Molecular Weight 381.526
MonoisotopicMass 382.174992
CLogP 4.2088
CLogS -8.193
H Acceptors 1
TotalSurfaceArea 176.01
Relative PSA 0.056815
PolarSurfaceArea 9.23
Drug-likeness -11.637
Mutagenic low
Tumorigenic low
Reproductive Effective low
Irritant none
Nasty Functions unwanted atom
Shape Index 0.53846
Molecula Flexibility 0.89166
Molecular Complexity 0.38376
Fragments 1
Non HAtoms 13
NonCHAtoms 2
Metal Atoms 1
Electronegative Atoms 1
Rotatable Bond 6
Sp3Atoms 12
Symmetricatoms 6

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