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P-611495301

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Name File
SDF P-611495301.sdf
SMILES P-611495301.smiles
Standard InChI P-611495301.inchi
InChIKey P-611495301.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-611495301 Toronto Research In stock 90 in stock
Property Value
Components 1
Mass 129.093
logP -0.5787
H-bond acceptors 4
H-bond donors 3
Rotatable bonds 0
PSA 72.5
RO5 violations 0
RO3 violations 2
Refractivity 27.8971
Atoms 13
Rings 1
Heavy atoms 9
Hydrogen atoms 4
Heteroatoms 5
N/O atoms 4
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 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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