(2R)-1,1-diphenylpropan-2-ol

CAS Number: 52199-85-6
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C[C@H](C(c1ccccc1)c1ccccc1)O
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C15H16O
Molecular Weight
212.291
Drug-likeness
-2.0905
CAS
52199-85-6
InChI key
BDZAWYBXBHTHFM-GFCCVEGCSA-N
SMILES
C[C@H](C(c1ccccc1)c1ccccc1)O
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 52199-85-6
Molecule Name (2R)-1,1-diphenylpropan-2-ol
Molecular Formula C15H16O
SMILES C[C@H](C(c1ccccc1)c1ccccc1)O
InChI InChI=1S/C15H16O/c1-12(16)15(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-12,15-16H,1H3/t12-/m1/s1
InChI Key BDZAWYBXBHTHFM-GFCCVEGCSA-N
CanonicalSyTyLFy 173aec505ebbbec8
TotalMolweight 212.291
Molecular Weight 212.291
MonoisotopicMass 212.120115
CLogP 3.3793
CLogS -3.139
H Acceptors 1
H Donors 1
TotalSurfaceArea 176.63
Relative PSA 0.074166
PolarSurfaceArea 20.23
Drug-likeness -2.0905
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.5625
Molecula Flexibility 0.54465
Molecular Complexity 0.53395
Fragments 1
Non HAtoms 16
NonCHAtoms 1
Electronegative Atoms 1
StereoCenters 1
Rotatable Bond 3
Rings Closures 2
Small Rings 2
Aromatic Rings 2
Aromatic Atoms 12
Sp3Atoms 4
Symmetricatoms 8
StereoCon this enantiomer

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