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  1. InChIKey:
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Name File
SDF P-869382614.sdf
SMILES P-869382614.smiles
Standard InChI P-869382614.inchi
InChIKey P-869382614.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-869382614 Manchester Organics Compounds on demand N/A by synthesis
Property Value
Components 1
Mass 88.062
logP -0.34
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 1
PSA 54.37
RO5 violations 0
RO3 violations 0
Refractivity 18.5068
Atoms 10
Rings 0
Heavy atoms 6
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