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P-611453006

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Name File
SDF P-611453006.sdf
SMILES P-611453006.smiles
Standard InChI P-611453006.inchi
InChIKey P-611453006.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-611453006 Toronto Research In stock 90 in stock
Property Value
Components 2
Mass 222.265
logP 0.5063
H-bond acceptors 6
H-bond donors 0
Rotatable bonds 2
PSA 83.62
RO5 violations 0
RO3 violations 2
Refractivity 50.7824
Atoms 28
Rings 1
Heavy atoms 14
Hydrogen atoms 14
Heteroatoms 7
N/O atoms 6
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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