Disodium sulfurimidate

CAS Number: 83930-11-4
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N=S([O-])([O-])=O.[Na+].[Na+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HNO3S.Na.Na
Molecular Weight
95.0779
Drug-likeness
-4.185
CAS
83930-11-4
InChI key
IGHQBRQFVQNPAO-UHFFFAOYSA-L
SMILES
N=S([O-])([O-])=O.[Na+].[Na+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 83930-11-4
Molecule Name Disodium sulfurimidate
Molecular Formula HNO3S.Na.Na
SMILES N=S([O-])([O-])=O.[Na+].[Na+]
InChI InChI=1S/H3NO3S.2Na/c1-5(2,3)4;;/h(H3,1,2,3,4);;/q;2*+1/p-2
InChI Key IGHQBRQFVQNPAO-UHFFFAOYSA-L
CanonicalSyTyLFy 9a50dc3c254a82c6
TotalMolweight 141.058
Molecular Weight 95.0779
MonoisotopicMass 94.967714
CLogP -5.3797
CLogS 1.328
H Acceptors 4
H Donors 1
TotalSurfaceArea 59.7
Relative PSA 1
PolarSurfaceArea 95.42
Drug-likeness -4.185
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.6
Molecular Complexity 0.80472
Fragments 3
Non HAtoms 5
NonCHAtoms 5
Electronegative Atoms 5
Sp3Atoms 3
Symmetricatoms 1

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