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P-611579548

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Name File
SDF P-611579548.sdf
SMILES P-611579548.smiles
Standard InChI P-611579548.inchi
InChIKey P-611579548.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-611579548 Toronto Research In stock 90 in stock
Property Value
Components 1
Mass 179.215
logP 1.9213
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 3
PSA 49.33
RO5 violations 0
RO3 violations 0
Refractivity 51.0752
Atoms 26
Rings 1
Heavy atoms 13
Hydrogen atoms 13
Heteroatoms 3
N/O atoms 3
Inorganic atoms 0
Halogen atoms 0
Chiral centers 0
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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