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  1. InChIKey:
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Name File
SDF P-855313352.sdf
SMILES P-855313352.smiles
Standard InChI P-855313352.inchi
InChIKey P-855313352.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-855313352 Toronto Research In stock N/A in stock May 10
Property Value
Components 2
Mass 158.094
logP 0.4967
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 0
PSA 77.52
RO5 violations 0
RO3 violations 2
Refractivity 31.8162
Atoms 14
Rings 2
Heavy atoms 11
Hydrogen atoms 3
Heteroatoms 6
N/O atoms 5
Inorganic atoms 1
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