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P-894003643

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Name File
SDF P-894003643.sdf
SMILES P-894003643.smiles
Standard InChI P-894003643.inchi
InChIKey P-894003643.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-894003643 eNovation Chemicals LLC Building Blocks in stock 95 in stock
Property Value
Components 2
Mass 454.125
logP 8.3387
H-bond acceptors 5
H-bond donors 0
Rotatable bonds 20
PSA 74.27
RO5 violations 1
RO3 violations 5
Refractivity 128.4554
Atoms 82
Rings 0
Heavy atoms 30
Hydrogen atoms 52
Heteroatoms 6
N/O atoms 5
Inorganic atoms 0
Halogen atoms 1
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
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