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P-489129554

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Name File
SDF P-489129554.sdf
SMILES P-489129554.smiles
Standard InChI P-489129554.inchi
InChIKey P-489129554.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-489129554 Amadis Chemical Company Limited Amadis Chemical General Catalog 97 in stock
Property Value
Components 2
Mass 533.570
logP 1.0177
H-bond acceptors 12
H-bond donors 2
Rotatable bonds 11
PSA 146.15
RO5 violations 2
RO3 violations 4
Refractivity 149.9026
Atoms 73
Rings 3
Heavy atoms 38
Hydrogen atoms 35
Heteroatoms 12
N/O atoms 12
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 2
Cis/trans stereo double bonds 2
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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