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P-893944080

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Name File
SDF P-893944080.sdf
SMILES P-893944080.smiles
Standard InChI P-893944080.inchi
InChIKey P-893944080.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-893944080 eNovation Chemicals LLC Building Blocks in stock 95 in stock
Property Value
Components 1
Mass 489.363
logP 2.9501
H-bond acceptors 7
H-bond donors 1
Rotatable bonds 7
PSA 92.42
RO5 violations 0
RO3 violations 4
Refractivity 102.6794
Atoms 52
Rings 3
Heavy atoms 33
Hydrogen atoms 19
Heteroatoms 15
N/O atoms 7
Inorganic atoms 0
Halogen atoms 8
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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