(2,2,6,6-Tetramethylthian-4-ylidene)hydrazine

CAS Number: 89050-83-9
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CC(C)(C1)SC(C)(C)CC1=NN
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C9H18N2S
Molecular Weight
186.322
Drug-likeness
0.57599
CAS
89050-83-9
InChI key
XYGCNSYTXIBCJN-UHFFFAOYSA-N
SMILES
CC(C)(C1)SC(C)(C)CC1=NN
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 89050-83-9
Molecule Name (2,2,6,6-Tetramethylthian-4-ylidene)hydrazine
Molecular Formula C9H18N2S
SMILES CC(C)(C1)SC(C)(C)CC1=NN
InChI InChI=1S/C9H18N2S/c1-8(2)5-7(11-10)6-9(3,4)12-8/h5-6,10H2,1-4H3
InChI Key XYGCNSYTXIBCJN-UHFFFAOYSA-N
CanonicalSyTyLFy 1474046a0fe121cb
TotalMolweight 186.322
Molecular Weight 186.322
MonoisotopicMass 186.119068
CLogP 3.0202
CLogS -2.808
H Acceptors 2
H Donors 1
TotalSurfaceArea 146.36
Relative PSA 0.30247
PolarSurfaceArea 63.68
Drug-likeness 0.57599
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.5
Molecula Flexibility 0.29281
Molecular Complexity 0.60626
Fragments 1
Non HAtoms 12
NonCHAtoms 3
Electronegative Atoms 3
Rings Closures 1
Small Rings 1
Sp3Atoms 10
Symmetricatoms 5

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