(2,4-Dimethylphenyl)hydrazine--hydrogen chloride (1/1)

CAS Number: 60480-83-3
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Cc(cc1)cc(C)c1NN.Cl
Molecule Information
Mutagenic: none Tumorigenic: high Irritant: low
Formula
HCl.C8H12N2
Molecular Weight
136.197
Drug-likeness
-4.51
CAS
60480-83-3
InChI key
ZLGXGLXFBMIVPU-UHFFFAOYSA-N
SMILES
Cc(cc1)cc(C)c1NN.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
high
Handling Watch
Irritant: low | Reproductive effective: none
PropertyValue
CAS Number 60480-83-3
Molecule Name (2,4-Dimethylphenyl)hydrazine--hydrogen chloride (1/1)
Molecular Formula HCl.C8H12N2
SMILES Cc(cc1)cc(C)c1NN.Cl
InChI InChI=1S/C8H12N2.ClH/c1-6-3-4-8(10-9)7(2)5-6;/h3-5,10H,9H2,1-2H3;1H
InChI Key ZLGXGLXFBMIVPU-UHFFFAOYSA-N
CanonicalSyTyLFy 32167246ce404666
TotalMolweight 172.658
Molecular Weight 136.197
MonoisotopicMass 136.100048
CLogP 2.3099
CLogS -2.098
H Acceptors 2
H Donors 2
TotalSurfaceArea 117.76
Relative PSA 0.22699
PolarSurfaceArea 38.05
Drug-likeness -4.51
Mutagenic none
Tumorigenic high
Reproductive Effective none
Irritant low
Nasty Functions hydrazine
Shape Index 0.7
Molecula Flexibility 0.017819
Molecular Complexity 0.65162
Fragments 2
Non HAtoms 10
NonCHAtoms 2
Electronegative Atoms 2
Rotatable Bond 1
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 3

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