(2-Fluorophenyl)phosphane

CAS Number: 647031-47-8
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Fc(cccc1)c1P
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C6H6FP
Molecular Weight
128.086
Drug-likeness
-5.5375
CAS
647031-47-8
InChI key
MGJUWNNLIIIAFX-UHFFFAOYSA-N
SMILES
Fc(cccc1)c1P
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 647031-47-8
Molecule Name (2-Fluorophenyl)phosphane
Molecular Formula C6H6FP
SMILES Fc(cccc1)c1P
InChI InChI=1S/C6H6FP/c7-5-3-1-2-4-6(5)8/h1-4H,8H2
InChI Key MGJUWNNLIIIAFX-UHFFFAOYSA-N
CanonicalSyTyLFy 7507a390bfbd3501
TotalMolweight 128.086
Molecular Weight 128.086
MonoisotopicMass 128.019115
CLogP 1.7629
CLogS -2.351
TotalSurfaceArea 72.86
Drug-likeness -5.5375
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.625
Molecular Complexity 0.64124
Fragments 1
Non HAtoms 8
NonCHAtoms 2
Electronegative Atoms 2
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 1

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