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P-893676064

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Name File
SDF P-893676064.sdf
SMILES P-893676064.smiles
Standard InChI P-893676064.inchi
InChIKey P-893676064.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-893676064 eNovation Chemicals LLC Building Block on demand 95 by synthesis
Property Value
Components 1
Mass 206.284
logP 3.216
H-bond acceptors 3
H-bond donors 2
Rotatable bonds 4
PSA 55.12
RO5 violations 0
RO3 violations 2
Refractivity 64.5461
Atoms 33
Rings 1
Heavy atoms 15
Hydrogen atoms 18
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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