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P-580278846

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Name File
SDF P-580278846.sdf
SMILES P-580278846.smiles
Standard InChI P-580278846.inchi
InChIKey P-580278846.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-580278846 Debye Scientific General Catalog 95 by resynthesis (? - ? days)
Property Value
Components 1
Mass 96.087
logP 0.2222
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 1
PSA 45.75
RO5 violations 0
RO3 violations 0
Refractivity 23.9752
Atoms 11
Rings 1
Heavy atoms 7
Hydrogen atoms 4
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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