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P-893861771

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Name File
SDF P-893861771.sdf
SMILES P-893861771.smiles
Standard InChI P-893861771.inchi
InChIKey P-893861771.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-893861771 eNovation Chemicals LLC Building Block on demand 95 by synthesis
Property Value
Components 1
Mass 228.242
logP 2.8913
H-bond acceptors 3
H-bond donors 1
Rotatable bonds 4
PSA 46.53
RO5 violations 0
RO3 violations 1
Refractivity 63.9998
Atoms 29
Rings 2
Heavy atoms 17
Hydrogen atoms 12
Heteroatoms 3
N/O atoms 3
Inorganic atoms 0
Halogen atoms 0
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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