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P-505412200

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Name File
SDF P-505412200.sdf
SMILES P-505412200.smiles
Standard InChI P-505412200.inchi
InChIKey P-505412200.txt
mcule product ID Supplier Catalog Purity (%) Product matching Availability Updated
P-505412200 BOCSCI All products 90 in stock July 6, 2017
Property Value
Components 1
Mass 220.319
logP 3.276
H-bond acceptors 2
H-bond donors 0
Rotatable bonds 3
PSA 76.38
RO5 violations 0
RO3 violations 2
Refractivity 60.188
Atoms 22
Rings 2
Heavy atoms 14
Hydrogen atoms 8
Heteroatoms 4
N/O atoms 2
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
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