(2,6-Dichloro-benzyl)-hydrazine

CAS Number: 51421-14-8
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NNCc(c(Cl)ccc1)c1Cl
Molecule Information
Mutagenic: low Tumorigenic: high Irritant: none
Formula
C7H8N2Cl2
Molecular Weight
191.061
Drug-likeness
-3.6016
CAS
51421-14-8
InChI key
FUJFXSUHLRUWEC-UHFFFAOYSA-N
SMILES
NNCc(c(Cl)ccc1)c1Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: low
PropertyValue
CAS Number 51421-14-8
Molecule Name (2,6-Dichloro-benzyl)-hydrazine
Molecular Formula C7H8N2Cl2
SMILES NNCc(c(Cl)ccc1)c1Cl
InChI InChI=1S/C7H8Cl2N2/c8-6-2-1-3-7(9)5(6)4-11-10/h1-3,11H,4,10H2
InChI Key FUJFXSUHLRUWEC-UHFFFAOYSA-N
CanonicalSyTyLFy 24fdf160d8847457
TotalMolweight 191.061
Molecular Weight 191.061
MonoisotopicMass 190.006452
CLogP 1.1124
CLogS -3.325
H Acceptors 2
H Donors 2
TotalSurfaceArea 137.84
Relative PSA 0.19392
PolarSurfaceArea 38.05
Drug-likeness -3.6016
Mutagenic low
Tumorigenic high
Reproductive Effective low
Irritant none
Nasty Functions hydrazine
Shape Index 0.63636
Molecula Flexibility 0.48032
Molecular Complexity 0.7167
Fragments 1
Non HAtoms 11
NonCHAtoms 4
Electronegative Atoms 4
Rotatable Bond 2
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 3
Symmetricatoms 3

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