4-Methoxyphenylhydrazine hydrochloride

CAS Number: 19501-58-7
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COc(cc1)ccc1NN.Cl
Molecule Information
Mutagenic: low Tumorigenic: high Irritant: none
Formula
HCl.C7H10N2O
Molecular Weight
138.169
Drug-likeness
-4.4026
CAS
19501-58-7
InChI key
FQHCPFMTXFJZJS-UHFFFAOYSA-N
SMILES
COc(cc1)ccc1NN.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 19501-58-7
Molecule Name 4-Methoxyphenylhydrazine hydrochloride
Molecular Formula HCl.C7H10N2O
SMILES COc(cc1)ccc1NN.Cl
InChI InChI=1S/C7H10N2O.ClH/c1-10-7-4-2-6(9-8)3-5-7;/h2-5,9H,8H2,1H3;1H
InChI Key FQHCPFMTXFJZJS-UHFFFAOYSA-N
CanonicalSyTyLFy 1588d72a284287e5
TotalMolweight 174.63
Molecular Weight 138.169
MonoisotopicMass 138.079313
CLogP 1.5521
CLogS -1.428
H Acceptors 3
H Donors 2
TotalSurfaceArea 115.5
Relative PSA 0.31801
PolarSurfaceArea 47.28
Drug-likeness -4.4026
Mutagenic low
Tumorigenic high
Reproductive Effective none
Irritant none
Nasty Functions hydrazine
Shape Index 0.8
Molecula Flexibility 0.39433
Molecular Complexity 0.57807
Fragments 2
Non HAtoms 10
NonCHAtoms 3
Electronegative Atoms 3
Rotatable Bond 2
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 3
Symmetricatoms 2

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