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P-855252704

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Name File
SDF P-855252704.sdf
SMILES P-855252704.smiles
Standard InChI P-855252704.inchi
InChIKey P-855252704.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-855252704 Toronto Research In stock 90 in stock
Property Value
Components 2
Mass 258.700
logP 2.5464
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 3
PSA 64.79
RO5 violations 0
RO3 violations 2
Refractivity 68.9224
Atoms 32
Rings 2
Heavy atoms 17
Hydrogen atoms 15
Heteroatoms 6
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
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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