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UNKNOWN STEREO

P-611353696

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Name File
SDF P-611353696.sdf
SMILES P-611353696.smiles
Standard InChI P-611353696.inchi
InChIKey P-611353696.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-611353696 Toronto Research In stock 90 in stock
Property Value
Components 1
Mass 90.078
logP -0.5482
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 1
PSA 57.53
RO5 violations 0
RO3 violations 0
Refractivity 19.4686
Atoms 12
Rings 0
Heavy atoms 6
Hydrogen atoms 6
Heteroatoms 3
N/O atoms 3
Inorganic atoms 0
Halogen atoms 0
Chiral centers 1
R/S chiral centers 1
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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