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P-852412554

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Name File
SDF P-852412554.sdf
SMILES P-852412554.smiles
Standard InChI P-852412554.inchi
InChIKey P-852412554.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-852412554 Matrix Scientific All N/A in stock
Property Value
Components 1
Mass 236.224
logP 0.8723
H-bond acceptors 6
H-bond donors 1
Rotatable bonds 3
PSA 77.52
RO5 violations 0
RO3 violations 2
Refractivity 61.6067
Atoms 29
Rings 2
Heavy atoms 17
Hydrogen atoms 12
Heteroatoms 6
N/O atoms 6
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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