Bis(acetyloxy)(dichloro)stannane

CAS Number: 1000-23-3
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CC(O[Sn](OC(C)=O)(Cl)Cl)=O
Molecule Information
Mutagenic: high Tumorigenic: high Irritant: low
Formula
C4H6O4Cl2Sn
Molecular Weight
307.704
Drug-likeness
-8.6766
CAS
1000-23-3
InChI key
WQENOBKKDOBQIX-UHFFFAOYSA-J
SMILES
CC(O[Sn](OC(C)=O)(Cl)Cl)=O
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
high
Handling Watch
Irritant: low | Reproductive effective: low
PropertyValue
CAS Number 1000-23-3
Molecule Name Bis(acetyloxy)(dichloro)stannane
Molecular Formula C4H6O4Cl2Sn
SMILES CC(O[Sn](OC(C)=O)(Cl)Cl)=O
InChI InChI=1S/2C2H4O2.2ClH.Sn/c2*1-2(3)4;;;/h2*1H3,(H,3,4);2*1H;/q;;;;+4/p-4
InChI Key WQENOBKKDOBQIX-UHFFFAOYSA-J
CanonicalSyTyLFy f6cece699b374794
TotalMolweight 307.704
Molecular Weight 307.704
MonoisotopicMass 307.866514
CLogP -0.4484
CLogS -1.122
H Acceptors 4
TotalSurfaceArea 137.86
Relative PSA 0.33425
PolarSurfaceArea 52.6
Drug-likeness -8.6766
Mutagenic high
Tumorigenic high
Reproductive Effective low
Irritant low
Nasty Functions unwanted atom
Shape Index 0.63636
Molecula Flexibility 0.83665
Molecular Complexity 0.52781
Fragments 1
Non HAtoms 11
NonCHAtoms 7
Metal Atoms 1
Electronegative Atoms 6
Rotatable Bond 4
Sp3Atoms 4
Symmetricatoms 5

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