Hydrazine, (2-(p-benzyloxyphenoxy)ethyl)-, hydrochloride

CAS Number: 69782-19-0
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NNCCOc(cc1)ccc1OCc1ccccc1.Cl
Molecule Information
Mutagenic: low Tumorigenic: high Irritant: none
Formula
HCl.C15H18N2O2
Molecular Weight
258.32
Drug-likeness
-3.2259
CAS
69782-19-0
InChI key
OLMAHXHGCBNNQK-UHFFFAOYSA-N
SMILES
NNCCOc(cc1)ccc1OCc1ccccc1.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: low
PropertyValue
CAS Number 69782-19-0
Molecule Name Hydrazine, (2-(p-benzyloxyphenoxy)ethyl)-, hydrochloride
Molecular Formula HCl.C15H18N2O2
SMILES NNCCOc(cc1)ccc1OCc1ccccc1.Cl
InChI InChI=1S/C15H18N2O2.ClH/c16-17-10-11-18-14-6-8-15(9-7-14)19-12-13-4-2-1-3-5-13;/h1-9,17H,10-12,16H2;1H
InChI Key OLMAHXHGCBNNQK-UHFFFAOYSA-N
CanonicalSyTyLFy bf40de8c6a1b9aac
TotalMolweight 294.781
Molecular Weight 258.32
MonoisotopicMass 258.136828
CLogP 1.2554
CLogS -3.121
H Acceptors 4
H Donors 2
TotalSurfaceArea 214.28
Relative PSA 0.21808
PolarSurfaceArea 56.51
Drug-likeness -3.2259
Mutagenic low
Tumorigenic high
Reproductive Effective low
Irritant none
Nasty Functions hydrazine
Shape Index 0.78947
Molecula Flexibility 0.53285
Molecular Complexity 0.53731
Fragments 2
Non HAtoms 19
NonCHAtoms 4
Electronegative Atoms 4
Rotatable Bond 7
Rings Closures 2
Small Rings 2
Aromatic Rings 2
Aromatic Atoms 12
Sp3Atoms 7
Symmetricatoms 4

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