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

CAS Number: 169789-35-9
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CCCCC/N=C(\N)/NN.I
Molecule Information
Mutagenic: none Tumorigenic: high Irritant: none
Formula
HI.C6H16N4
Molecular Weight
144.221
Drug-likeness
-7.7425
CAS
169789-35-9
InChI key
IESUXRUKTRCBED-UHFFFAOYSA-N
SMILES
CCCCC/N=C(\N)/NN.I
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 169789-35-9
Molecule Name N'-Pentylhydrazinecarboximidamide--hydrogen iodide (1/1)
Molecular Formula HI.C6H16N4
SMILES CCCCC/N=C(\N)/NN.I
InChI InChI=1S/C6H16N4.HI/c1-2-3-4-5-9-6(7)10-8;/h2-5,8H2,1H3,(H3,7,9,10);1H
InChI Key IESUXRUKTRCBED-UHFFFAOYSA-N
CanonicalSyTyLFy 5033299d35e6a2b6
TotalMolweight 272.129
Molecular Weight 144.221
MonoisotopicMass 144.137496
CLogP -0.1876
CLogS -2.241
H Acceptors 4
H Donors 3
TotalSurfaceArea 132.27
Relative PSA 0.40455
PolarSurfaceArea 76.43
Drug-likeness -7.7425
Mutagenic none
Tumorigenic high
Reproductive Effective none
Irritant none
Nasty Functions hydrazine
Shape Index 0.9
Molecula Flexibility 0.54614
Molecular Complexity 0.51986
Fragments 2
Non HAtoms 10
NonCHAtoms 4
Electronegative Atoms 4
Rotatable Bond 4
Sp3Atoms 6
BasicNitrogens 1

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