(2-Methyl-2,3-dihydro-1H-cyclopenta[a]naphthalen-1-ylidene)hydrazine

CAS Number: 837369-59-2
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CC(Cc1c2c3ccccc3cc1)C2=NN
Molecule Information
Mutagenic: high Tumorigenic: high Irritant: none
Formula
C14H14N2
Molecular Weight
210.279
Drug-likeness
-1.5303
CAS
837369-59-2
InChI key
AGQJUHLHBBRTDQ-VIFPVBQESA-N
SMILES
CC(Cc1c2c3ccccc3cc1)C2=NN
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 837369-59-2
Molecule Name (2-Methyl-2,3-dihydro-1H-cyclopenta[a]naphthalen-1-ylidene)hydrazine
Molecular Formula C14H14N2
SMILES CC(Cc1c2c3ccccc3cc1)C2=NN
InChI InChI=1S/C14H14N2/c1-9-8-11-7-6-10-4-2-3-5-12(10)13(11)14(9)16-15/h2-7,9H,8,15H2,1H3/t9-/m0/s1
InChI Key AGQJUHLHBBRTDQ-VIFPVBQESA-N
CanonicalSyTyLFy 123baeb7f5af4a27
TotalMolweight 210.279
Molecular Weight 210.279
MonoisotopicMass 210.115698
CLogP 3.3612
CLogS -4.838
H Acceptors 2
H Donors 1
TotalSurfaceArea 164.37
Relative PSA 0.16293
PolarSurfaceArea 38.38
Drug-likeness -1.5303
Mutagenic high
Tumorigenic high
Reproductive Effective none
Irritant none
Shape Index 0.5
Molecular Complexity 0.78648
Fragments 1
Non HAtoms 16
NonCHAtoms 2
Electronegative Atoms 2
StereoCenters 1
Rings Closures 3
Small Rings 3
Aromatic Rings 2
Aromatic Atoms 10
Sp3Atoms 4
StereoCon racemate

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