(2-Phenylpropyl)hydrazine

CAS Number: 875-88-7
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CC(CNN)c1ccccc1
Molecule Information
Mutagenic: low Tumorigenic: high Irritant: none
Formula
C9H14N2
Molecular Weight
150.224
Drug-likeness
-2.253
CAS
875-88-7
InChI key
CKEKULWTUGAESO-QMMMGPOBSA-N
SMILES
CC(CNN)c1ccccc1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: low
PropertyValue
CAS Number 875-88-7
Molecule Name (2-Phenylpropyl)hydrazine
Molecular Formula C9H14N2
SMILES CC(CNN)c1ccccc1
InChI InChI=1S/C9H14N2/c1-8(7-11-10)9-5-3-2-4-6-9/h2-6,8,11H,7,10H2,1H3/t8-/m0/s1
InChI Key CKEKULWTUGAESO-QMMMGPOBSA-N
CanonicalSyTyLFy 638613ea3c146272
TotalMolweight 150.224
Molecular Weight 150.224
MonoisotopicMass 150.115698
CLogP 0.758
CLogS -2.333
H Acceptors 2
H Donors 2
TotalSurfaceArea 131.76
Relative PSA 0.20287
PolarSurfaceArea 38.05
Drug-likeness -2.253
Mutagenic low
Tumorigenic high
Reproductive Effective low
Irritant none
Nasty Functions hydrazine
Shape Index 0.72727
Molecula Flexibility 0.53503
Molecular Complexity 0.57807
Fragments 1
Non HAtoms 11
NonCHAtoms 2
Electronegative Atoms 2
StereoCenters 1
Rotatable Bond 3
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 5
Symmetricatoms 2
StereoCon racemate

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