(+/-)-Norfenfluramine

CAS Number: 1886-26-6
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CC(Cc1cccc(C(F)(F)F)c1)N
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C10H12NF3
Molecular Weight
203.206
Drug-likeness
-8.6407
CAS
1886-26-6
InChI key
MLBHFBKZUPLWBD-ZETCQYMHSA-N
SMILES
CC(Cc1cccc(C(F)(F)F)c1)N
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 1886-26-6
Molecule Name (+/-)-Norfenfluramine
Molecular Formula C10H12NF3
SMILES CC(Cc1cccc(C(F)(F)F)c1)N
InChI InChI=1S/C10H12F3N/c1-7(14)5-8-3-2-4-9(6-8)10(11,12)13/h2-4,6-7H,5,14H2,1H3/t7-/m0/s1
InChI Key MLBHFBKZUPLWBD-ZETCQYMHSA-N
CanonicalSyTyLFy a940c126c1f50e72
TotalMolweight 203.206
Molecular Weight 203.206
MonoisotopicMass 203.092183
CLogP 2.3022
CLogS -2.844
H Acceptors 1
H Donors 1
TotalSurfaceArea 149.76
Relative PSA 0.10196
PolarSurfaceArea 26.02
Drug-likeness -8.6407
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.57143
Molecula Flexibility 0.6048
Molecular Complexity 0.63466
Fragments 1
Non HAtoms 14
NonCHAtoms 4
Electronegative Atoms 4
StereoCenters 1
Rotatable Bond 3
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 5
Symmetricatoms 2
Amines 1
AlkylAmines 1
BasicNitrogens 1
StereoCon racemate

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