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  1. InChIKey:
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Name File
SDF P-481610167.sdf
SMILES P-481610167.smiles
Standard InChI P-481610167.inchi
InChIKey P-481610167.txt
mcule product ID Supplier Catalog Purity (%) Product matching Availability Updated
P-481610167 Scientific Exchange, Inc. Compounds from stock in Eastern Europe N/A in stock June 13, 2016
Property Value
Components 1
Mass 343.333
logP 2.4934
H-bond acceptors 8
H-bond donors 0
Rotatable bonds 5
PSA 99.58
RO5 violations 0
RO3 violations 4
Refractivity 98.335
Atoms 42
Rings 3
Heavy atoms 25
Hydrogen atoms 17
Heteroatoms 8
N/O atoms 8
Inorganic atoms 0
Halogen atoms 0
Chiral centers 0
R/S chiral centers 0
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