N''-Methylhydrazinecarboximidohydrazide--hydrogen iodide (1/1)

CAS Number: 56204-45-6
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CN=C(NN)NN.I
Molecule Information
Mutagenic: none Tumorigenic: high Irritant: none
Formula
HI.C2H9N5
Molecular Weight
103.128
Drug-likeness
-2.542
CAS
56204-45-6
InChI key
LJBHGSURLFDEBM-UHFFFAOYSA-N
SMILES
CN=C(NN)NN.I
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 56204-45-6
Molecule Name N''-Methylhydrazinecarboximidohydrazide--hydrogen iodide (1/1)
Molecular Formula HI.C2H9N5
SMILES CN=C(NN)NN.I
InChI InChI=1S/C2H9N5.HI/c1-5-2(6-3)7-4;/h3-4H2,1H3,(H2,5,6,7);1H
InChI Key LJBHGSURLFDEBM-UHFFFAOYSA-N
CanonicalSyTyLFy dddfc27c888147ad
TotalMolweight 231.036
Molecular Weight 103.128
MonoisotopicMass 103.085795
CLogP -2.7212
CLogS -1.408
H Acceptors 5
H Donors 4
TotalSurfaceArea 88.69
Relative PSA 0.73255
PolarSurfaceArea 88.46
Drug-likeness -2.542
Mutagenic none
Tumorigenic high
Reproductive Effective none
Irritant none
Nasty Functions hydrazine
Shape Index 0.71429
Molecula Flexibility 0.59162
Molecular Complexity 0.59725
Fragments 2
Non HAtoms 7
NonCHAtoms 5
Electronegative Atoms 5
Sp3Atoms 3
Symmetricatoms 2
BasicNitrogens 1

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