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P-580272294

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Name File
SDF P-580272294.sdf
SMILES P-580272294.smiles
Standard InChI P-580272294.inchi
InChIKey P-580272294.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-580272294 Debye Scientific General Catalog 95 by resynthesis (? - ? days)
Property Value
Components 2
Mass 200.707
logP 3.4982
H-bond acceptors 2
H-bond donors 1
Rotatable bonds 3
PSA 29.26
RO5 violations 0
RO3 violations 1
Refractivity 61.6324
Atoms 30
Rings 1
Heavy atoms 13
Hydrogen atoms 17
Heteroatoms 3
N/O atoms 2
Inorganic atoms 0
Halogen atoms 1
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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