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P-867305501

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Name File
SDF P-867305501.sdf
SMILES P-867305501.smiles
Standard InChI P-867305501.inchi
InChIKey P-867305501.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-867305501 A2B Chem Predominantly Building Block on demand N/A by synthesis
Property Value
Components 1
Mass 277.747
logP 2.5569
H-bond acceptors 4
H-bond donors 1
Rotatable bonds 2
PSA 49.25
RO5 violations 0
RO3 violations 1
Refractivity 79.9658
Atoms 35
Rings 3
Heavy atoms 19
Hydrogen atoms 16
Heteroatoms 5
N/O atoms 4
Inorganic atoms 0
Halogen atoms 1
Chiral centers 1
R/S chiral centers 0
Unknown chiral centers 0
Undefined chiral centers 1
Stereo double bonds 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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