Potassium methyldiazen-1-olate

CAS Number: 87039-32-5
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C/N=N/[O-].[K+]
Molecule Information
Mutagenic: none Tumorigenic: low Irritant: none
Formula
K.CH3N2O
Molecular Weight
59.0478
Drug-likeness
-3.304
CAS
87039-32-5
InChI key
UTIZIVHEEXBLNZ-UHFFFAOYSA-M
SMILES
C/N=N/[O-].[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
low
Handling Watch
Irritant: none | Reproductive effective: low
PropertyValue
CAS Number 87039-32-5
Molecule Name Potassium methyldiazen-1-olate
Molecular Formula K.CH3N2O
SMILES C/N=N/[O-].[K+]
InChI InChI=1S/CH4N2O.K/c1-2-3-4;/h1H3,(H,2,4);/q;+1/p-1
InChI Key UTIZIVHEEXBLNZ-UHFFFAOYSA-M
CanonicalSyTyLFy 906b89d1227a5367
TotalMolweight 98.1458
Molecular Weight 59.0478
MonoisotopicMass 59.024538
CLogP 0.5323
CLogS -0.523
H Acceptors 3
TotalSurfaceArea 56.31
Relative PSA 0.6624
PolarSurfaceArea 47.78
Drug-likeness -3.304
Mutagenic none
Tumorigenic low
Reproductive Effective low
Irritant none
Shape Index 1
Fragments 2
Non HAtoms 4
NonCHAtoms 3
Electronegative Atoms 3
Sp3Atoms 2

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