N-Cyclohexylhydroxylamine hydrochloride

CAS Number: 25100-12-3
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ONC1CCCCC1.Cl
Molecule Information
Mutagenic: high Tumorigenic: none Irritant: none
Formula
HCl.C6H13NO
Molecular Weight
115.175
Drug-likeness
-5.6329
CAS
25100-12-3
InChI key
SSVAHXZUFFSFER-UHFFFAOYSA-N
SMILES
ONC1CCCCC1.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 25100-12-3
Molecule Name N-Cyclohexylhydroxylamine hydrochloride
Molecular Formula HCl.C6H13NO
SMILES ONC1CCCCC1.Cl
InChI InChI=1S/C6H13NO.ClH/c8-7-6-4-2-1-3-5-6;/h6-8H,1-5H2;1H
InChI Key SSVAHXZUFFSFER-UHFFFAOYSA-N
CanonicalSyTyLFy 26658a5cbe890b7a
TotalMolweight 151.636
Molecular Weight 115.175
MonoisotopicMass 115.099714
CLogP 0.6855
CLogS -2.026
H Acceptors 2
H Donors 2
TotalSurfaceArea 99.11
Relative PSA 0.24781
PolarSurfaceArea 32.26
Drug-likeness -5.6329
Mutagenic high
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.75
Molecula Flexibility 0.4168
Molecular Complexity 0.54931
Fragments 2
Non HAtoms 8
NonCHAtoms 2
Electronegative Atoms 2
Rotatable Bond 1
Rings Closures 1
Small Rings 1
Sp3Atoms 8
Symmetricatoms 2

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