(2R)-2-(4-Fluorophenyl)-4-methylmorpholine

CAS Number: 920802-15-9
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CN1C[C@@H](c(cc2)ccc2F)OCC1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C11H14NOF
Molecular Weight
195.236
Drug-likeness
3.7326
CAS
920802-15-9
InChI key
MLCKFDUWYLGQKE-NSHDSACASA-N
SMILES
CN1C[C@@H](c(cc2)ccc2F)OCC1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 920802-15-9
Molecule Name (2R)-2-(4-Fluorophenyl)-4-methylmorpholine
Molecular Formula C11H14NOF
SMILES CN1C[C@@H](c(cc2)ccc2F)OCC1
InChI InChI=1S/C11H14FNO/c1-13-6-7-14-11(8-13)9-2-4-10(12)5-3-9/h2-5,11H,6-8H2,1H3/t11-/m0/s1
InChI Key MLCKFDUWYLGQKE-NSHDSACASA-N
CanonicalSyTyLFy 6e1920489a280741
TotalMolweight 195.236
Molecular Weight 195.236
MonoisotopicMass 195.105942
CLogP 1.4504
CLogS -1.282
H Acceptors 2
TotalSurfaceArea 152.45
Relative PSA 0.088882
PolarSurfaceArea 12.47
Drug-likeness 3.7326
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.64286
Molecula Flexibility 0.41645
Molecular Complexity 0.64283
Fragments 1
Non HAtoms 14
NonCHAtoms 3
Electronegative Atoms 3
StereoCenters 1
Rotatable Bond 1
Rings Closures 2
Small Rings 2
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 7
Symmetricatoms 2
Amines 1
AlkylAmines 1
BasicNitrogens 1
StereoCon this enantiomer

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