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P-489162840

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Name File
SDF P-489162840.sdf
SMILES P-489162840.smiles
Standard InChI P-489162840.inchi
InChIKey P-489162840.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-489162840 Amadis Chemical Company Limited Amadis Chemical General Catalog 97 in stock December 20, 2016
Property Value
Components 2
Mass 474.974
logP 3.6979
H-bond acceptors 7
H-bond donors 2
Rotatable bonds 11
PSA 95.94
RO5 violations 0
RO3 violations 5
Refractivity 131.4585
Atoms 64
Rings 3
Heavy atoms 33
Hydrogen atoms 31
Heteroatoms 8
N/O atoms 7
Inorganic atoms 0
Halogen atoms 1
Chiral centers 3
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 3
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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