Cyclooctylhydrazine--hydrogen chloride (1/1)

CAS Number: 92379-99-2
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NNC1CCCCCCC1.Cl
Molecule Information
Mutagenic: none Tumorigenic: high Irritant: none
Formula
HCl.C8H18N2
Molecular Weight
142.245
Drug-likeness
-8.2408
CAS
92379-99-2
InChI key
DETRYHIQWXYEMG-UHFFFAOYSA-N
SMILES
NNC1CCCCCCC1.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 92379-99-2
Molecule Name Cyclooctylhydrazine--hydrogen chloride (1/1)
Molecular Formula HCl.C8H18N2
SMILES NNC1CCCCCCC1.Cl
InChI InChI=1S/C8H18N2.ClH/c9-10-8-6-4-2-1-3-5-7-8;/h8,10H,1-7,9H2;1H
InChI Key DETRYHIQWXYEMG-UHFFFAOYSA-N
CanonicalSyTyLFy 163649b88ced0c57
TotalMolweight 178.706
Molecular Weight 142.245
MonoisotopicMass 142.146998
CLogP 1.4515
CLogS -2.644
H Acceptors 2
H Donors 2
TotalSurfaceArea 128.8
Relative PSA 0.20753
PolarSurfaceArea 38.05
Drug-likeness -8.2408
Mutagenic none
Tumorigenic high
Reproductive Effective none
Irritant none
Nasty Functions hydrazine
Shape Index 0.7
Molecula Flexibility 0.4041
Molecular Complexity 0.47958
Fragments 2
Non HAtoms 10
NonCHAtoms 2
Electronegative Atoms 2
Rotatable Bond 1
Rings Closures 1
Sp3Atoms 10
Symmetricatoms 3

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