(1Z,3Z,5Z,7Z)-Cyclonona-1,3,5,7-tetraene

CAS Number: 7129-70-6
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C1/C=C\C=C/C=C\C=C1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C9H10
Molecular Weight
118.178
Drug-likeness
-2.5215
CAS
7129-70-6
InChI key
GORPVKZVZYAFSO-UHFFFAOYSA-N
SMILES
C1/C=C\C=C/C=C\C=C1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 7129-70-6
Molecule Name (1Z,3Z,5Z,7Z)-Cyclonona-1,3,5,7-tetraene
Molecular Formula C9H10
SMILES C1/C=C\C=C/C=C\C=C1
InChI InChI=1S/C9H10/c1-2-4-6-8-9-7-5-3-1/h1-8H,9H2
InChI Key GORPVKZVZYAFSO-UHFFFAOYSA-N
CanonicalSyTyLFy d8caa9c066229acb
TotalMolweight 118.178
Molecular Weight 118.178
MonoisotopicMass 118.07825
CLogP 3.0808
CLogS -2.048
TotalSurfaceArea 119.76
Drug-likeness -2.5215
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.55556
Molecula Flexibility 0.1676
Molecular Complexity 0.44794
Fragments 1
Non HAtoms 9
Rings Closures 1
Sp3Atoms 1
Symmetricatoms 4

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