(Cyclopropylmethyl)hydrazine--hydrogen chloride (1/2)

CAS Number: 809282-61-9
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NNCC1CC1.Cl.Cl
Molecule Information
Mutagenic: low Tumorigenic: high Irritant: none
Formula
HCl.HCl.C4H10N2
Molecular Weight
86.1374
Drug-likeness
-0.99443
CAS
809282-61-9
InChI key
JTJBBDAUIXOTHL-UHFFFAOYSA-N
SMILES
NNCC1CC1.Cl.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: low
PropertyValue
CAS Number 809282-61-9
Molecule Name (Cyclopropylmethyl)hydrazine--hydrogen chloride (1/2)
Molecular Formula HCl.HCl.C4H10N2
SMILES NNCC1CC1.Cl.Cl
InChI InChI=1S/C4H10N2.2ClH/c5-6-3-4-1-2-4;;/h4,6H,1-3,5H2;2*1H
InChI Key JTJBBDAUIXOTHL-UHFFFAOYSA-N
CanonicalSyTyLFy e4430464a5e83cc
TotalMolweight 159.059
Molecular Weight 86.1374
MonoisotopicMass 86.084398
CLogP -0.7933
CLogS -1.346
H Acceptors 2
H Donors 2
TotalSurfaceArea 73.76
Relative PSA 0.36239
PolarSurfaceArea 38.05
Drug-likeness -0.99443
Mutagenic low
Tumorigenic high
Reproductive Effective low
Irritant none
Nasty Functions hydrazine
Shape Index 0.83333
Molecula Flexibility 0.53909
Molecular Complexity 0.53648
Fragments 3
Non HAtoms 6
NonCHAtoms 2
Electronegative Atoms 2
Rotatable Bond 2
Rings Closures 1
Small Rings 1
Sp3Atoms 6
Symmetricatoms 1

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