(2-Ethylbutyl)hydrazine

CAS Number: 70082-39-2
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CCC(CC)CNN
Molecule Information
Mutagenic: low Tumorigenic: high Irritant: none
Formula
C6H16N2
Molecular Weight
116.207
Drug-likeness
-2.6299
CAS
70082-39-2
InChI key
QGVQZJSYAIMPHI-UHFFFAOYSA-N
SMILES
CCC(CC)CNN
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: low
PropertyValue
CAS Number 70082-39-2
Molecule Name (2-Ethylbutyl)hydrazine
Molecular Formula C6H16N2
SMILES CCC(CC)CNN
InChI InChI=1S/C6H16N2/c1-3-6(4-2)5-8-7/h6,8H,3-5,7H2,1-2H3
InChI Key QGVQZJSYAIMPHI-UHFFFAOYSA-N
CanonicalSyTyLFy a6a5bd846c2eabfa
TotalMolweight 116.207
Molecular Weight 116.207
MonoisotopicMass 116.131348
CLogP 0.4701
CLogS -1.8
H Acceptors 2
H Donors 2
TotalSurfaceArea 111.78
Relative PSA 0.23913
PolarSurfaceArea 38.05
Drug-likeness -2.6299
Mutagenic low
Tumorigenic high
Reproductive Effective low
Irritant none
Nasty Functions hydrazine
Shape Index 0.75
Molecula Flexibility 0.84374
Molecular Complexity 0.53648
Fragments 1
Non HAtoms 8
NonCHAtoms 2
Electronegative Atoms 2
Rotatable Bond 4
Sp3Atoms 8
Symmetricatoms 2

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