(1-Ethoxyethenyl)(trimethyl)stannane

CAS Number: 112713-84-5
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CCOC([Sn](C)(C)C)=C
Molecule Information
Mutagenic: high Tumorigenic: none Irritant: low
Formula
C7H16OSn
Molecular Weight
234.913
Drug-likeness
-12.213
CAS
112713-84-5
InChI key
RLRBAMDAFZZWMM-UHFFFAOYSA-N
SMILES
CCOC([Sn](C)(C)C)=C
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
none
Handling Watch
Irritant: low | Reproductive effective: low
PropertyValue
CAS Number 112713-84-5
Molecule Name (1-Ethoxyethenyl)(trimethyl)stannane
Molecular Formula C7H16OSn
SMILES CCOC([Sn](C)(C)C)=C
InChI InChI=1S/C4H7O.3CH3.Sn/c1-3-5-4-2;;;;/h1,4H2,2H3;3*1H3;
InChI Key RLRBAMDAFZZWMM-UHFFFAOYSA-N
CanonicalSyTyLFy 4f6ca1bcc20b6534
TotalMolweight 234.913
Molecular Weight 234.913
MonoisotopicMass 236.022315
CLogP 3.2786
CLogS -1.702
H Acceptors 1
TotalSurfaceArea 122.55
Relative PSA 0.081599
PolarSurfaceArea 9.23
Drug-likeness -12.213
Mutagenic high
Tumorigenic none
Reproductive Effective low
Irritant low
Nasty Functions unwanted atom
Shape Index 0.66667
Molecula Flexibility 0.79324
Molecular Complexity 0.51986
Fragments 1
Non HAtoms 9
NonCHAtoms 2
Metal Atoms 1
Electronegative Atoms 1
Rotatable Bond 3
Sp3Atoms 6
Symmetricatoms 2

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