(2-Methoxy-5-methylphenyl)hydrazine--hydrogen chloride (1/1)

CAS Number: 65208-14-2
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Cc(cc1)cc(NN)c1OC.Cl
Molecule Information
Mutagenic: none Tumorigenic: high Irritant: none
Formula
HCl.C8H12N2O
Molecular Weight
152.196
Drug-likeness
-4.4618
CAS
65208-14-2
InChI key
LNNNLIDIPZDTKB-UHFFFAOYSA-N
SMILES
Cc(cc1)cc(NN)c1OC.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 65208-14-2
Molecule Name (2-Methoxy-5-methylphenyl)hydrazine--hydrogen chloride (1/1)
Molecular Formula HCl.C8H12N2O
SMILES Cc(cc1)cc(NN)c1OC.Cl
InChI InChI=1S/C8H12N2O.ClH/c1-6-3-4-8(11-2)7(5-6)10-9;/h3-5,10H,9H2,1-2H3;1H
InChI Key LNNNLIDIPZDTKB-UHFFFAOYSA-N
CanonicalSyTyLFy 8ddba5e5febb6f20
TotalMolweight 188.657
Molecular Weight 152.196
MonoisotopicMass 152.094963
CLogP 1.896
CLogS -1.772
H Acceptors 3
H Donors 2
TotalSurfaceArea 127.76
Relative PSA 0.28749
PolarSurfaceArea 47.28
Drug-likeness -4.4618
Mutagenic none
Tumorigenic high
Reproductive Effective none
Irritant none
Nasty Functions hydrazine
Shape Index 0.63636
Molecula Flexibility 0.03261
Molecular Complexity 0.70527
Fragments 2
Non HAtoms 11
NonCHAtoms 3
Electronegative Atoms 3
Rotatable Bond 2
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 4

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