Cyclopropanecarboximidamide--hydrogen chloride (1/1)

CAS Number: 54070-74-5
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NC(C1CC1)=N.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HCl.C4H8N2
Molecular Weight
84.1215
Drug-likeness
0.15814
CAS
54070-74-5
InChI key
JRYOZJIRAVZGMV-UHFFFAOYSA-N
SMILES
NC(C1CC1)=N.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 54070-74-5
Molecule Name Cyclopropanecarboximidamide--hydrogen chloride (1/1)
Molecular Formula HCl.C4H8N2
SMILES NC(C1CC1)=N.Cl
InChI InChI=1S/C4H8N2.ClH/c5-4(6)3-1-2-3;/h3H,1-2H2,(H3,5,6);1H
InChI Key JRYOZJIRAVZGMV-UHFFFAOYSA-N
CanonicalSyTyLFy 7ed26256c3338598
TotalMolweight 120.582
Molecular Weight 84.1215
MonoisotopicMass 84.068748
CLogP -0.7778
CLogS -0.231
H Acceptors 2
H Donors 2
TotalSurfaceArea 68.85
Relative PSA 0.44837
PolarSurfaceArea 49.87
Drug-likeness 0.15814
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.66667
Molecula Flexibility 0.51894
Molecular Complexity 0.59725
Fragments 2
Non HAtoms 6
NonCHAtoms 2
Electronegative Atoms 2
Rotatable Bond 1
Rings Closures 1
Small Rings 1
Sp3Atoms 3
Symmetricatoms 1
BasicNitrogens 1

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