(2-amino-5-methylphenyl)(phenyl)methanol

CAS Number: 156261-32-4
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Cc(cc1)cc(C(c2ccccc2)O)c1N
Molecule Information
Mutagenic: high Tumorigenic: low Irritant: none
Formula
C14H15NO
Molecular Weight
213.279
Drug-likeness
-1.1192
CAS
156261-32-4
InChI key
RFGHBTFPMINONZ-AWEZNQCLSA-N
SMILES
Cc(cc1)cc(C(c2ccccc2)O)c1N
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
low
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 156261-32-4
Molecule Name (2-amino-5-methylphenyl)(phenyl)methanol
Molecular Formula C14H15NO
SMILES Cc(cc1)cc(C(c2ccccc2)O)c1N
InChI InChI=1S/C14H15NO/c1-10-7-8-13(15)12(9-10)14(16)11-5-3-2-4-6-11/h2-9,14,16H,15H2,1H3/t14-/m0/s1
InChI Key RFGHBTFPMINONZ-AWEZNQCLSA-N
CanonicalSyTyLFy 76f5f541f7b9cb01
TotalMolweight 213.279
Molecular Weight 213.279
MonoisotopicMass 213.115364
CLogP 2.4447
CLogS -3.18
H Acceptors 2
H Donors 2
TotalSurfaceArea 172.65
Relative PSA 0.16432
PolarSurfaceArea 46.25
Drug-likeness -1.1192
Mutagenic high
Tumorigenic low
Reproductive Effective none
Irritant none
Shape Index 0.5625
Molecula Flexibility 0.40832
Molecular Complexity 0.63799
Fragments 1
Non HAtoms 16
NonCHAtoms 2
Electronegative Atoms 2
StereoCenters 1
Rotatable Bond 2
Rings Closures 2
Small Rings 2
Aromatic Rings 2
Aromatic Atoms 12
Sp3Atoms 3
Symmetricatoms 2
Amines 1
Aromatic Amines 1
StereoCon racemate

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