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P-894000155

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Name File
SDF P-894000155.sdf
SMILES P-894000155.smiles
Standard InChI P-894000155.inchi
InChIKey P-894000155.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-894000155 eNovation Chemicals LLC Building Blocks in stock 95 in stock
Property Value
Components 2
Mass 332.865
logP 3.3343
H-bond acceptors 3
H-bond donors 0
Rotatable bonds 1
PSA 23.55
RO5 violations 0
RO3 violations 2
Refractivity 101.9625
Atoms 48
Rings 5
Heavy atoms 23
Hydrogen atoms 25
Heteroatoms 4
N/O atoms 3
Inorganic atoms 0
Halogen atoms 1
Chiral centers 2
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 2
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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