Potassium, 1H-inden-1-yl-

CAS Number: 12128-56-2
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[cH-](cc1)c2c1cccc2.[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.C9H7
Molecular Weight
115.155
Drug-likeness
-2.3575
CAS
12128-56-2
InChI key
UOKNXAWCFOSJMN-UHFFFAOYSA-N
SMILES
[cH-](cc1)c2c1cccc2.[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 12128-56-2
Molecule Name Potassium, 1H-inden-1-yl-
Molecular Formula K.C9H7
SMILES [cH-](cc1)c2c1cccc2.[K+]
InChI InChI=1S/C9H7.K/c1-2-5-9-7-3-6-8(9)4-1;/h1-7H;/q-1;+1
InChI Key UOKNXAWCFOSJMN-UHFFFAOYSA-N
CanonicalSyTyLFy 6076243547e1235c
TotalMolweight 154.253
Molecular Weight 115.155
MonoisotopicMass 115.054775
CLogP 2.3008
CLogS -3.041
TotalSurfaceArea 95.65
Drug-likeness -2.3575
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.55556
Molecular Complexity 0.63561
Fragments 2
Non HAtoms 9
Rings Closures 2
Small Rings 2
Aromatic Rings 2
Aromatic Atoms 9
Sp3Atoms 1

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