(2R)-2-(3-Fluorophenyl)morpholine

CAS Number: 920802-29-5
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Fc1cc([C@H]2OCCNC2)ccc1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C10H12NOF
Molecular Weight
181.209
Drug-likeness
-0.061007
CAS
920802-29-5
InChI key
OLENKPLLMGPQSX-JTQLQIEISA-N
SMILES
Fc1cc([C@H]2OCCNC2)ccc1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 920802-29-5
Molecule Name (2R)-2-(3-Fluorophenyl)morpholine
Molecular Formula C10H12NOF
SMILES Fc1cc([C@H]2OCCNC2)ccc1
InChI InChI=1S/C10H12FNO/c11-9-3-1-2-8(6-9)10-7-12-4-5-13-10/h1-3,6,10,12H,4-5,7H2/t10-/m0/s1
InChI Key OLENKPLLMGPQSX-JTQLQIEISA-N
CanonicalSyTyLFy 5a245634ee8aaed2
TotalMolweight 181.209
Molecular Weight 181.209
MonoisotopicMass 181.090292
CLogP 1.1975
CLogS -1.644
H Acceptors 2
H Donors 1
TotalSurfaceArea 141.35
Relative PSA 0.15182
PolarSurfaceArea 21.26
Drug-likeness -0.061007
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.61538
Molecula Flexibility 0.42069
Molecular Complexity 0.65353
Fragments 1
Non HAtoms 13
NonCHAtoms 3
Electronegative Atoms 3
StereoCenters 1
Rotatable Bond 1
Rings Closures 2
Small Rings 2
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 6
Amines 1
AlkylAmines 1
BasicNitrogens 1
StereoCon this enantiomer

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