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P-580418399

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Name File
SDF P-580418399.sdf
SMILES P-580418399.smiles
Standard InChI P-580418399.inchi
InChIKey P-580418399.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-580418399 Debye Scientific General Catalog 95 by resynthesis (? - ? days)
Property Value
Components 1
Mass 164.963
logP 2.0293
H-bond acceptors 1
H-bond donors 0
Rotatable bonds 2
PSA 9.23
RO5 violations 0
RO3 violations 0
Refractivity 27.352
Atoms 12
Rings 0
Heavy atoms 8
Hydrogen atoms 4
Heteroatoms 5
N/O atoms 1
Inorganic atoms 0
Halogen atoms 4
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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