Pentylhydrazine hydrochloride

CAS Number: 1119-68-2
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CCCCCNN.Cl
Molecule Information
Mutagenic: low Tumorigenic: high Irritant: none
Formula
HCl.C5H14N2
Molecular Weight
102.18
Drug-likeness
-8.7108
CAS
1119-68-2
InChI key
OUHMCZPSMWROKK-UHFFFAOYSA-N
SMILES
CCCCCNN.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: low
PropertyValue
CAS Number 1119-68-2
Molecule Name Pentylhydrazine hydrochloride
Molecular Formula HCl.C5H14N2
SMILES CCCCCNN.Cl
InChI InChI=1S/C5H14N2.ClH/c1-2-3-4-5-7-6;/h7H,2-6H2,1H3;1H
InChI Key OUHMCZPSMWROKK-UHFFFAOYSA-N
CanonicalSyTyLFy a45bb4e4c56e9720
TotalMolweight 138.641
Molecular Weight 102.18
MonoisotopicMass 102.115698
CLogP 0.2518
CLogS -1.64
H Acceptors 2
H Donors 2
TotalSurfaceArea 100.78
Relative PSA 0.26523
PolarSurfaceArea 38.05
Drug-likeness -8.7108
Mutagenic low
Tumorigenic high
Reproductive Effective low
Irritant none
Nasty Functions hydrazine
Shape Index 1
Molecula Flexibility 0.64685
Molecular Complexity 0.4621
Fragments 2
Non HAtoms 7
NonCHAtoms 2
Electronegative Atoms 2
Rotatable Bond 4
Sp3Atoms 7

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