Fluoro(nitro)boranyl

CAS Number: 143654-30-2
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[O-][N+](BF)=O
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
NO2BF
Molecular Weight
75.814
Drug-likeness
-8.779
CAS
143654-30-2
InChI key
UGLYNVLAQMOOEA-UHFFFAOYSA-N
SMILES
[O-][N+](BF)=O
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 143654-30-2
Molecule Name Fluoro(nitro)boranyl
Molecular Formula NO2BF
SMILES [O-][N+](BF)=O
InChI InChI=1S/BFNO2/c2-1-3(4)5
InChI Key UGLYNVLAQMOOEA-UHFFFAOYSA-N
CanonicalSyTyLFy 48171280fca1d5c5
TotalMolweight 75.814
Molecular Weight 75.814
MonoisotopicMass 76.000612
CLogP -0.68
CLogS -0.322
H Acceptors 3
TotalSurfaceArea 43.52
Relative PSA 0.69899
PolarSurfaceArea 45.82
Drug-likeness -8.779
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Nasty Functions unwanted atom
Shape Index 0.8
Molecula Flexibility 0.61655
Molecular Complexity 0.69315
Fragments 1
Non HAtoms 5
NonCHAtoms 5
Electronegative Atoms 4
Rotatable Bond 1
Sp3Atoms 1
AcidicOxygens 1

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