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P-580377356

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Name File
SDF P-580377356.sdf
SMILES P-580377356.smiles
Standard InChI P-580377356.inchi
InChIKey P-580377356.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-580377356 Debye Scientific General Catalog N/A by resynthesis (? - ? days)
Property Value
Components 1
Mass 127.141
logP 0.3195
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 1
PSA 49.33
RO5 violations 0
RO3 violations 0
Refractivity 36.8565
Atoms 18
Rings 1
Heavy atoms 9
Hydrogen atoms 9
Heteroatoms 3
N/O atoms 3
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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