Hydrazine, (2-amino-5-methyl-4-pyrimidinyl)-, hydrochloride

CAS Number: 74038-72-5
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Cc1c(NN)nc(N)nc1.Cl
Molecule Information
Mutagenic: none Tumorigenic: high Irritant: none
Formula
HCl.C5H9N5
Molecular Weight
139.161
Drug-likeness
-4.5617
CAS
74038-72-5
InChI key
RJXORBSCATUBLD-UHFFFAOYSA-N
SMILES
Cc1c(NN)nc(N)nc1.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 74038-72-5
Molecule Name Hydrazine, (2-amino-5-methyl-4-pyrimidinyl)-, hydrochloride
Molecular Formula HCl.C5H9N5
SMILES Cc1c(NN)nc(N)nc1.Cl
InChI InChI=1S/C5H9N5.ClH/c1-3-2-8-5(6)9-4(3)10-7;/h2H,7H2,1H3,(H3,6,8,9,10);1H
InChI Key RJXORBSCATUBLD-UHFFFAOYSA-N
CanonicalSyTyLFy 92865004de4d744b
TotalMolweight 175.622
Molecular Weight 139.161
MonoisotopicMass 139.085795
CLogP 0.4464
CLogS -1.622
H Acceptors 5
H Donors 3
TotalSurfaceArea 111.54
Relative PSA 0.57325
PolarSurfaceArea 89.85
Drug-likeness -4.5617
Mutagenic none
Tumorigenic high
Reproductive Effective none
Irritant none
Nasty Functions hydrazine
Shape Index 0.6
Molecula Flexibility 0.13465
Molecular Complexity 0.6868
Fragments 2
Non HAtoms 10
NonCHAtoms 5
Electronegative Atoms 5
Rotatable Bond 1
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 2
Aromatic Nitrogens 2
BasicNitrogens 2

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