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P-611522434

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Name File
SDF P-611522434.sdf
SMILES P-611522434.smiles
Standard InChI P-611522434.inchi
InChIKey P-611522434.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-611522434 Toronto Research In stock 90 in stock
Property Value
Components 1
Mass 177.199
logP 1.1143
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 1
PSA 49.33
RO5 violations 0
RO3 violations 0
Refractivity 52.3625
Atoms 24
Rings 2
Heavy atoms 13
Hydrogen atoms 11
Heteroatoms 3
N/O atoms 3
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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