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  1. InChIKey:
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Name File
SDF P-489201164.sdf
SMILES P-489201164.smiles
Standard InChI P-489201164.inchi
InChIKey P-489201164.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-489201164 Amadis Chemical Company Limited Amadis Chemical General Catalog 97 in stock
Property Value
Components 2
Mass 211.617
logP -4.7945
H-bond acceptors 6
H-bond donors 2
Rotatable bonds 3
PSA 120.72
RO5 violations 0
RO3 violations 2
Refractivity 23.3246
Atoms 15
Rings 0
Heavy atoms 11
Hydrogen atoms 4
Heteroatoms 7
N/O atoms 6
Inorganic atoms 1
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