Trimethyl(thiophen-3-yl)germane

CAS Number: 100099-21-6
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C[Ge](C)(C)c1cscc1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C7H12GeS
Molecular Weight
200.848
Drug-likeness
-0.83327
CAS
100099-21-6
InChI key
FIFDWVZLIBSZQD-UHFFFAOYSA-N
SMILES
C[Ge](C)(C)c1cscc1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 100099-21-6
Molecule Name Trimethyl(thiophen-3-yl)germane
Molecular Formula C7H12GeS
SMILES C[Ge](C)(C)c1cscc1
InChI InChI=1S/C7H12GeS/c1-8(2,3)7-4-5-9-6-7/h4-6H,1-3H3
InChI Key FIFDWVZLIBSZQD-UHFFFAOYSA-N
CanonicalSyTyLFy 84ba21fb93e8c9ab
TotalMolweight 200.848
Molecular Weight 200.848
MonoisotopicMass 201.987147
CLogP 3.2575
CLogS -1.905
TotalSurfaceArea 119.48
Relative PSA 0.17041
PolarSurfaceArea 28.24
Drug-likeness -0.83327
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions unwanted atom
Shape Index 0.55556
Molecula Flexibility 0.55733
Molecular Complexity 0.67701
Fragments 1
Non HAtoms 9
NonCHAtoms 2
Electronegative Atoms 1
Rotatable Bond 1
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 5
Sp3Atoms 3
Symmetricatoms 2

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