Magnesium, 1H-indol-1-yliodo-

CAS Number: 13884-15-6
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c1c[n-]c2c1cccc2.[Mg+2].[I-]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
I.Mg.C8H6N
Molecular Weight
116.143
Drug-likeness
-1.2305
CAS
13884-15-6
InChI key
WUOHHBBDIXOSSD-UHFFFAOYSA-M
SMILES
c1c[n-]c2c1cccc2.[Mg+2].[I-]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 13884-15-6
Molecule Name Magnesium, 1H-indol-1-yliodo-
Molecular Formula I.Mg.C8H6N
SMILES c1c[n-]c2c1cccc2.[Mg+2].[I-]
InChI InChI=1S/C8H6N.HI.Mg/c1-2-4-8-7(3-1)5-6-9-8;;/h1-6H;1H;/q-1;;+2/p-1
InChI Key WUOHHBBDIXOSSD-UHFFFAOYSA-M
CanonicalSyTyLFy 418ac1ada17ce3fc
TotalMolweight 267.348
Molecular Weight 116.143
MonoisotopicMass 116.050024
CLogP -0.2788
CLogS -2.141
H Acceptors 1
TotalSurfaceArea 83.44
Drug-likeness -1.2305
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.55556
Molecular Complexity 0.6993
Fragments 3
Non HAtoms 9
NonCHAtoms 1
Electronegative Atoms 1
Rings Closures 2
Small Rings 2
Aromatic Rings 2
Aromatic Atoms 9
Aromatic Nitrogens 1

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