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P-580232951

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Name File
SDF P-580232951.sdf
SMILES P-580232951.smiles
Standard InChI P-580232951.inchi
InChIKey P-580232951.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-580232951 Aldlab Chemicals Building Block Custom Synth 95 by synthesis
Property Value
Components 2
Mass 360.705
logP 5.5426
H-bond acceptors 2
H-bond donors 0
Rotatable bonds 1
PSA 19.84
RO5 violations 1
RO3 violations 2
Refractivity 84.006
Atoms 41
Rings 2
Heavy atoms 21
Hydrogen atoms 20
Heteroatoms 10
N/O atoms 2
Inorganic atoms 0
Halogen atoms 7
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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