Germane, benzoyltriethyl-

CAS Number: 13433-78-8
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CC[Ge](CC)(CC)C(c1ccccc1)=O
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C13H20OGe
Molecular Weight
264.911
Drug-likeness
-1.9209
CAS
13433-78-8
InChI key
XABLEWSFDXCERP-UHFFFAOYSA-N
SMILES
CC[Ge](CC)(CC)C(c1ccccc1)=O
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 13433-78-8
Molecule Name Germane, benzoyltriethyl-
Molecular Formula C13H20OGe
SMILES CC[Ge](CC)(CC)C(c1ccccc1)=O
InChI InChI=1S/C13H20GeO/c1-4-14(5-2,6-3)13(15)12-10-8-7-9-11-12/h7-11H,4-6H2,1-3H3
InChI Key XABLEWSFDXCERP-UHFFFAOYSA-N
CanonicalSyTyLFy f46be338d8cefd6e
TotalMolweight 264.911
Molecular Weight 264.911
MonoisotopicMass 266.072592
CLogP 4.1539
CLogS -10.245
H Acceptors 1
TotalSurfaceArea 182.57
Relative PSA 0.071425
PolarSurfaceArea 17.07
Drug-likeness -1.9209
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions unwanted atom
Shape Index 0.53333
Molecula Flexibility 0.71893
Molecular Complexity 0.50791
Fragments 1
Non HAtoms 15
NonCHAtoms 2
Electronegative Atoms 1
Rotatable Bond 5
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 6
Symmetricatoms 6

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