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P-894005956

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Name File
SDF P-894005956.sdf
SMILES P-894005956.smiles
Standard InChI P-894005956.inchi
InChIKey P-894005956.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-894005956 eNovation Chemicals LLC Building Blocks in stock 95 in stock
Property Value
Components 1
Mass 239.314
logP 0.6769
H-bond acceptors 5
H-bond donors 2
Rotatable bonds 3
PSA 75.43
RO5 violations 0
RO3 violations 2
Refractivity 72.2051
Atoms 38
Rings 2
Heavy atoms 17
Hydrogen atoms 21
Heteroatoms 5
N/O atoms 5
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 0
Cis/trans stereo double bonds 0
Unknown stereo double bonds 0
Undefined stereo double bonds 0
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