(2,2,5,5-Tetramethylcyclopent-3-en-1-ylidene)hydrazine

CAS Number: 81396-37-4
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CC(C)(C=CC1(C)C)C1=NN
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C9H16N2
Molecular Weight
152.24
Drug-likeness
-2.6224
CAS
81396-37-4
InChI key
ZYYBWVXOJNKZJG-UHFFFAOYSA-N
SMILES
CC(C)(C=CC1(C)C)C1=NN
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 81396-37-4
Molecule Name (2,2,5,5-Tetramethylcyclopent-3-en-1-ylidene)hydrazine
Molecular Formula C9H16N2
SMILES CC(C)(C=CC1(C)C)C1=NN
InChI InChI=1S/C9H16N2/c1-8(2)5-6-9(3,4)7(8)11-10/h5-6H,10H2,1-4H3
InChI Key ZYYBWVXOJNKZJG-UHFFFAOYSA-N
CanonicalSyTyLFy cf9b2a0389b561cb
TotalMolweight 152.24
Molecular Weight 152.24
MonoisotopicMass 152.131348
CLogP 1.9017
CLogS -2.431
H Acceptors 2
H Donors 1
TotalSurfaceArea 127.85
Relative PSA 0.20946
PolarSurfaceArea 38.38
Drug-likeness -2.6224
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.45455
Molecular Complexity 0.71107
Fragments 1
Non HAtoms 11
NonCHAtoms 2
Electronegative Atoms 2
Rings Closures 1
Small Rings 1
Sp3Atoms 7
Symmetricatoms 5

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