Tributyl[(methoxymethoxy)methyl]stannane

CAS Number: 100045-83-8
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CCCC[Sn](CCCC)(CCCC)COCOC
Molecule Information
Mutagenic: high Tumorigenic: none Irritant: low
Formula
C15H34O2Sn
Molecular Weight
365.143
Drug-likeness
-6.6294
CAS
100045-83-8
InChI key
MHKKJWZUBFCJSI-UHFFFAOYSA-N
SMILES
CCCC[Sn](CCCC)(CCCC)COCOC
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
none
Handling Watch
Irritant: low | Reproductive effective: low
PropertyValue
CAS Number 100045-83-8
Molecule Name Tributyl[(methoxymethoxy)methyl]stannane
Molecular Formula C15H34O2Sn
SMILES CCCC[Sn](CCCC)(CCCC)COCOC
InChI InChI=1S/3C4H9.C3H7O2.Sn/c3*1-3-4-2;1-4-3-5-2;/h3*1,3-4H2,2H3;1,3H2,2H3;
InChI Key MHKKJWZUBFCJSI-UHFFFAOYSA-N
CanonicalSyTyLFy e800ced69d5af779
TotalMolweight 365.143
Molecular Weight 365.143
MonoisotopicMass 366.15808
CLogP 5.8512
CLogS -10.633
H Acceptors 2
TotalSurfaceArea 247.4
Relative PSA 0.080841
PolarSurfaceArea 18.46
Drug-likeness -6.6294
Mutagenic high
Tumorigenic none
Reproductive Effective low
Irritant low
Nasty Functions unwanted atom
Shape Index 0.55556
Molecula Flexibility 0.84589
Molecular Complexity 0.44793
Fragments 1
Non HAtoms 18
NonCHAtoms 3
Metal Atoms 1
Electronegative Atoms 2
Rotatable Bond 13
Sp3Atoms 17
Symmetricatoms 8

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