(1S)-1-(9H-Fluoren-9-yl)ethan-1-ol

CAS Number: 151775-20-1
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C[C@@H](C1c(cccc2)c2-c2c1cccc2)O
Molecule Information
Mutagenic: high Tumorigenic: high Irritant: none
Formula
C15H14O
Molecular Weight
210.275
Drug-likeness
-2.0905
CAS
151775-20-1
InChI key
YSCDFPXLCCWBIS-JTQLQIEISA-N
SMILES
C[C@@H](C1c(cccc2)c2-c2c1cccc2)O
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 151775-20-1
Molecule Name (1S)-1-(9H-Fluoren-9-yl)ethan-1-ol
Molecular Formula C15H14O
SMILES C[C@@H](C1c(cccc2)c2-c2c1cccc2)O
InChI InChI=1S/C15H14O/c1-10(16)15-13-8-4-2-6-11(13)12-7-3-5-9-14(12)15/h2-10,15-16H,1H3/t10-/m0/s1
InChI Key YSCDFPXLCCWBIS-JTQLQIEISA-N
CanonicalSyTyLFy 9267ef45f97673bf
TotalMolweight 210.275
Molecular Weight 210.275
MonoisotopicMass 210.104465
CLogP 2.7606
CLogS -4.139
H Acceptors 1
H Donors 1
TotalSurfaceArea 163.13
Relative PSA 0.080304
PolarSurfaceArea 20.23
Drug-likeness -2.0905
Mutagenic high
Tumorigenic high
Reproductive Effective none
Irritant none
Shape Index 0.4375
Molecula Flexibility 0.19044
Molecular Complexity 0.77245
Fragments 1
Non HAtoms 16
NonCHAtoms 1
Electronegative Atoms 1
StereoCenters 1
Rotatable Bond 1
Rings Closures 3
Small Rings 3
Aromatic Rings 2
Aromatic Atoms 12
Sp3Atoms 4
Symmetricatoms 6
StereoCon this enantiomer

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