N-Methylbenzohydrazide--hydrogen chloride (1/1)

CAS Number: 1660-25-9
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CN(C(c1ccccc1)=O)N.Cl
Molecule Information
Mutagenic: high Tumorigenic: low Irritant: none
Formula
HCl.C8H10N2O
Molecular Weight
150.18
Drug-likeness
-0.35809
CAS
1660-25-9
InChI key
HUEIPMFFNOGWLU-UHFFFAOYSA-N
SMILES
CN(C(c1ccccc1)=O)N.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
low
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 1660-25-9
Molecule Name N-Methylbenzohydrazide--hydrogen chloride (1/1)
Molecular Formula HCl.C8H10N2O
SMILES CN(C(c1ccccc1)=O)N.Cl
InChI InChI=1S/C8H10N2O.ClH/c1-10(9)8(11)7-5-3-2-4-6-7;/h2-6H,9H2,1H3;1H
InChI Key HUEIPMFFNOGWLU-UHFFFAOYSA-N
CanonicalSyTyLFy d0283fbb46436b89
TotalMolweight 186.641
Molecular Weight 150.18
MonoisotopicMass 150.079313
CLogP 0.0198
CLogS -1.477
H Acceptors 3
H Donors 1
TotalSurfaceArea 122.09
Relative PSA 0.26096
PolarSurfaceArea 46.33
Drug-likeness -0.35809
Mutagenic high
Tumorigenic low
Reproductive Effective none
Irritant none
Shape Index 0.63636
Molecula Flexibility 0.55302
Molecular Complexity 0.6089
Fragments 2
Non HAtoms 11
NonCHAtoms 3
Electronegative Atoms 3
Rotatable Bond 1
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 2
Symmetricatoms 2

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