(1,2,3,4,5-Pentafluorocyclopenta-2,4-dien-1-yl)phosphane

CAS Number: 89935-80-8
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FC(C(F)=C1F)(C(F)=C1F)P
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C5H2F5P
Molecular Weight
188.035
Drug-likeness
-4.3434
CAS
89935-80-8
InChI key
RLRWWNKPKASYQS-UHFFFAOYSA-N
SMILES
FC(C(F)=C1F)(C(F)=C1F)P
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 89935-80-8
Molecule Name (1,2,3,4,5-Pentafluorocyclopenta-2,4-dien-1-yl)phosphane
Molecular Formula C5H2F5P
SMILES FC(C(F)=C1F)(C(F)=C1F)P
InChI InChI=1S/C5H2F5P/c6-1-2(7)4(9)5(10,11)3(1)8/h11H2
InChI Key RLRWWNKPKASYQS-UHFFFAOYSA-N
CanonicalSyTyLFy 71be8797e27c8be1
TotalMolweight 188.035
Molecular Weight 188.035
MonoisotopicMass 187.981427
CLogP 2.2486
CLogS -4.721
TotalSurfaceArea 81.25
Drug-likeness -4.3434
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.45455
Molecular Complexity 0.80507
Fragments 1
Non HAtoms 11
NonCHAtoms 6
Electronegative Atoms 6
Rings Closures 1
Small Rings 1
Sp3Atoms 2
Symmetricatoms 4

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