O-[2-(Morpholin-4-yl)ethyl]hydroxylamine--hydrogen chloride (1/1)

CAS Number: 72423-24-6
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NOCCN1CCOCC1.Cl
Molecule Information
Mutagenic: high Tumorigenic: none Irritant: none
Formula
HCl.C6H14N2O2
Molecular Weight
146.189
Drug-likeness
1.8244
CAS
72423-24-6
InChI key
LXUKBCJTQUUAPJ-UHFFFAOYSA-N
SMILES
NOCCN1CCOCC1.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 72423-24-6
Molecule Name O-[2-(Morpholin-4-yl)ethyl]hydroxylamine--hydrogen chloride (1/1)
Molecular Formula HCl.C6H14N2O2
SMILES NOCCN1CCOCC1.Cl
InChI InChI=1S/C6H14N2O2.ClH/c7-10-6-3-8-1-4-9-5-2-8;/h1-7H2;1H
InChI Key LXUKBCJTQUUAPJ-UHFFFAOYSA-N
CanonicalSyTyLFy db8e75612fb6dd1e
TotalMolweight 182.65
Molecular Weight 146.189
MonoisotopicMass 146.105528
CLogP -1.1324
CLogS -0.07
H Acceptors 4
H Donors 1
TotalSurfaceArea 121.38
Relative PSA 0.31982
PolarSurfaceArea 47.72
Drug-likeness 1.8244
Mutagenic high
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.8
Molecula Flexibility 0.6046
Molecular Complexity 0.54161
Fragments 2
Non HAtoms 10
NonCHAtoms 4
Electronegative Atoms 4
Rotatable Bond 3
Rings Closures 1
Small Rings 1
Sp3Atoms 10
Symmetricatoms 2
Amines 1
AlkylAmines 1
BasicNitrogens 1

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