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  1. InChIKey:
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Name File
SDF P-611473782.sdf
SMILES P-611473782.smiles
Standard InChI P-611473782.inchi
InChIKey P-611473782.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-611473782 Toronto Research In stock 90 in stock
Property Value
Components 2
Mass 380.280
logP 5.6992
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 1
PSA 54.8
RO5 violations 1
RO3 violations 2
Refractivity 107.1111
Atoms 42
Rings 4
Heavy atoms 24
Hydrogen atoms 18
Heteroatoms 4
N/O atoms 3
Inorganic atoms 0
Halogen atoms 1
Chiral centers 0
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 0
Stereo double bonds 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0