(2E)-4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Pentadecafluorodec-2-ene

CAS Number: 89889-22-5
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C/C=C/C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C10H5F15
Molecular Weight
410.12
Drug-likeness
-105.41
CAS
89889-22-5
InChI key
MIEYGLYKERILQG-UHFFFAOYSA-N
SMILES
C/C=C/C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 89889-22-5
Molecule Name (2E)-4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Pentadecafluorodec-2-ene
Molecular Formula C10H5F15
SMILES C/C=C/C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI InChI=1S/C10H5F15/c1-2-3-4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)9(21,22)10(23,24)25/h2-3H,1H3
InChI Key MIEYGLYKERILQG-UHFFFAOYSA-N
CanonicalSyTyLFy 38c659d6e49478b6
TotalMolweight 410.12
Molecular Weight 410.12
MonoisotopicMass 410.01517
CLogP 6.3721
CLogS -6.344
TotalSurfaceArea 220.38
Drug-likeness -105.41
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.44
Molecula Flexibility 0.52217
Molecular Complexity 0.87147
Fragments 1
Non HAtoms 25
NonCHAtoms 15
Electronegative Atoms 15
Rotatable Bond 7
Sp3Atoms 8
Symmetricatoms 8

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