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UNKNOWN STEREO

P-855032159

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Name File
SDF P-855032159.sdf
SMILES P-855032159.smiles
Standard InChI P-855032159.inchi
InChIKey P-855032159.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-855032159 Toronto Research In stock 90 in stock
Property Value
Components 1
Mass 275.346
logP 2.1677
H-bond acceptors 5
H-bond donors 1
Rotatable bonds 3
PSA 44.81
RO5 violations 0
RO3 violations 1
Refractivity 84.9337
Atoms 41
Rings 3
Heavy atoms 20
Hydrogen atoms 21
Heteroatoms 5
N/O atoms 5
Inorganic atoms 0
Halogen atoms 0
Chiral centers 2
R/S chiral centers 2
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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