Phosphinic acid, phenyl-, potassium salt

CAS Number: 16263-37-9
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[O-]P(c1ccccc1)=O.[K+]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
K.C6H6O2P
Molecular Weight
141.086
Drug-likeness
-12.099
CAS
16263-37-9
InChI key
VENHOSDSAVICHW-UHFFFAOYSA-M
SMILES
[O-]P(c1ccccc1)=O.[K+]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 16263-37-9
Molecule Name Phosphinic acid, phenyl-, potassium salt
Molecular Formula K.C6H6O2P
SMILES [O-]P(c1ccccc1)=O.[K+]
InChI InChI=1S/C6H7O2P.K/c7-9(8)6-4-2-1-3-5-6;/h1-5,9H,(H,7,8);/q;+1/p-1
InChI Key VENHOSDSAVICHW-UHFFFAOYSA-M
CanonicalSyTyLFy 8c1a39326ae9401a
TotalMolweight 180.184
Molecular Weight 141.086
MonoisotopicMass 141.010542
CLogP -1.4021
CLogS -1.762
H Acceptors 2
TotalSurfaceArea 102.28
Relative PSA 0.34973
PolarSurfaceArea 63.6
Drug-likeness -12.099
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.66667
Molecula Flexibility 0.35005
Molecular Complexity 0.62123
Fragments 2
Non HAtoms 9
NonCHAtoms 3
Electronegative Atoms 3
StereoCenters 1
Rotatable Bond 1
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 2
Symmetricatoms 2
AcidicOxygens 1
StereoCon racemate

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