(1,1'-Biphenyl)-2-ol, 5-amino-

CAS Number: 19434-42-5
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Nc(cc1)cc(-c2ccccc2)c1O
Molecule Information
Mutagenic: low Tumorigenic: high Irritant: none
Formula
C12H11NO
Molecular Weight
185.225
Drug-likeness
-1.7657
CAS
19434-42-5
InChI key
OUIITAOCYATDMY-UHFFFAOYSA-N
SMILES
Nc(cc1)cc(-c2ccccc2)c1O
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
low
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 19434-42-5
Molecule Name (1,1'-Biphenyl)-2-ol, 5-amino-
Molecular Formula C12H11NO
SMILES Nc(cc1)cc(-c2ccccc2)c1O
InChI InChI=1S/C12H11NO/c13-10-6-7-12(14)11(8-10)9-4-2-1-3-5-9/h1-8,14H,13H2
InChI Key OUIITAOCYATDMY-UHFFFAOYSA-N
CanonicalSyTyLFy 358ae196b74b6ba
TotalMolweight 185.225
Molecular Weight 185.225
MonoisotopicMass 185.084064
CLogP 2.2958
CLogS -3.482
H Acceptors 2
H Donors 2
TotalSurfaceArea 147.89
Relative PSA 0.19183
PolarSurfaceArea 46.25
Drug-likeness -1.7657
Mutagenic low
Tumorigenic high
Reproductive Effective none
Irritant none
Shape Index 0.57143
Molecula Flexibility 0.36944
Molecular Complexity 0.64123
Fragments 1
Non HAtoms 14
NonCHAtoms 2
Electronegative Atoms 2
Rotatable Bond 1
Rings Closures 2
Small Rings 2
Aromatic Rings 2
Aromatic Atoms 12
Sp3Atoms 1
Symmetricatoms 2
Amines 1
Aromatic Amines 1

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