Phosphorodifluoridic acid

CAS Number: 13779-41-4
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OP(F)(F)=O
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HO2F2P
Molecular Weight
101.976
Drug-likeness
-8.0775
CAS
13779-41-4
InChI key
DGTVXEHQMSJRPE-UHFFFAOYSA-N
SMILES
OP(F)(F)=O
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 13779-41-4
Molecule Name Phosphorodifluoridic acid
Molecular Formula HO2F2P
SMILES OP(F)(F)=O
InChI InChI=1S/F2HO2P/c1-5(2,3)4/h(H,3,4)
InChI Key DGTVXEHQMSJRPE-UHFFFAOYSA-N
CanonicalSyTyLFy c19a92095f6c3d5
TotalMolweight 101.976
Molecular Weight 101.976
MonoisotopicMass 101.968223
CLogP -0.4253
CLogS 2.34
H Acceptors 2
H Donors 1
TotalSurfaceArea 56.32
Relative PSA 0.5348
PolarSurfaceArea 47.11
Drug-likeness -8.0775
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions acyl-halogenide type
Shape Index 0.6
Molecular Complexity 0.89588
Fragments 1
Non HAtoms 5
NonCHAtoms 5
Electronegative Atoms 5
Sp3Atoms 2
Symmetricatoms 1
AcidicOxygens 1

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