(2-Phenylcyclohexyl)hydrazine

CAS Number: 688302-95-6
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NNC(CCCC1)C1c1ccccc1
Molecule Information
Mutagenic: none Tumorigenic: high Irritant: none
Formula
C12H18N2
Molecular Weight
190.289
Drug-likeness
-7.8459
CAS
688302-95-6
InChI key
NSYGJTNLXWPPCJ-UHFFFAOYSA-N
SMILES
NNC(CCCC1)C1c1ccccc1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 688302-95-6
Molecule Name (2-Phenylcyclohexyl)hydrazine
Molecular Formula C12H18N2
SMILES NNC(CCCC1)C1c1ccccc1
InChI InChI=1S/C12H18N2/c13-14-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,11-12,14H,4-5,8-9,13H2
InChI Key NSYGJTNLXWPPCJ-UHFFFAOYSA-N
CanonicalSyTyLFy 7082c67cf064dc76
TotalMolweight 190.289
Molecular Weight 190.289
MonoisotopicMass 190.146998
CLogP 1.7824
CLogS -3.337
H Acceptors 2
H Donors 2
TotalSurfaceArea 159.78
Relative PSA 0.16729
PolarSurfaceArea 38.05
Drug-likeness -7.8459
Mutagenic none
Tumorigenic high
Reproductive Effective none
Irritant none
Nasty Functions hydrazine
Shape Index 0.57143
Molecula Flexibility 0.47497
Molecular Complexity 0.626
Fragments 1
Non HAtoms 14
NonCHAtoms 2
Electronegative Atoms 2
StereoCenters 2
Rotatable Bond 2
Rings Closures 2
Small Rings 2
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 8
Symmetricatoms 2
StereoCon unknown chirality

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