2-(Tributylstannyl)propene

CAS Number: 100073-15-2
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CCCC[Sn](CCCC)(CCCC)C(C)=C
Molecule Information
Mutagenic: high Tumorigenic: none Irritant: low
Formula
C15H32Sn
Molecular Weight
331.129
Drug-likeness
-11.798
CAS
100073-15-2
InChI key
PUMSLVXNEXVCIC-UHFFFAOYSA-N
SMILES
CCCC[Sn](CCCC)(CCCC)C(C)=C
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
none
Handling Watch
Irritant: low | Reproductive effective: low
PropertyValue
CAS Number 100073-15-2
Molecule Name 2-(Tributylstannyl)propene
Molecular Formula C15H32Sn
SMILES CCCC[Sn](CCCC)(CCCC)C(C)=C
InChI InChI=1S/3C4H9.C3H5.Sn/c3*1-3-4-2;1-3-2;/h3*1,3-4H2,2H3;1H2,2H3;
InChI Key PUMSLVXNEXVCIC-UHFFFAOYSA-N
CanonicalSyTyLFy dfec77a03fa2aef1
TotalMolweight 331.129
Molecular Weight 331.129
MonoisotopicMass 332.1526
CLogP 6.4891
CLogS -10.1
TotalSurfaceArea 222.63
Drug-likeness -11.798
Mutagenic high
Tumorigenic none
Reproductive Effective low
Irritant low
Nasty Functions unwanted atom
Shape Index 0.5625
Molecula Flexibility 0.85003
Molecular Complexity 0.42063
Fragments 1
Non HAtoms 16
NonCHAtoms 1
Metal Atoms 1
Rotatable Bond 10
Sp3Atoms 13
Symmetricatoms 8

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