hexazine

CAS Number: 7616-35-5
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n1nnnnn1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
N6
Molecular Weight
84.042
Drug-likeness
-1.7675
CAS
7616-35-5
InChI key
YRBKSJIXFZPPGF-UHFFFAOYSA-N
SMILES
n1nnnnn1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 7616-35-5
Molecule Name hexazine
Molecular Formula N6
SMILES n1nnnnn1
InChI InChI=1S/N6/c1-2-4-6-5-3-1
InChI Key YRBKSJIXFZPPGF-UHFFFAOYSA-N
CanonicalSyTyLFy 16bb8cbcec7d7bbd
TotalMolweight 84.042
Molecular Weight 84.042
MonoisotopicMass 84.018444
CLogP -0.4668
CLogS -1.55
H Acceptors 6
TotalSurfaceArea 65.82
Relative PSA 1
PolarSurfaceArea 77.34
Drug-likeness -1.7675
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.66667
Molecular Complexity 0.4621
Fragments 1
Non HAtoms 6
NonCHAtoms 6
Electronegative Atoms 6
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Symmetricatoms 5
Aromatic Nitrogens 6

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