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P-867443672

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  1. InChIKey:
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Name File
SDF P-867443672.sdf
SMILES P-867443672.smiles
Standard InChI P-867443672.inchi
InChIKey P-867443672.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-867443672 A2B Chem Predominantly Building Block on demand N/A by synthesis
Property Value
Components 3
Mass 216.223
logP -2.842
H-bond acceptors 10
H-bond donors 6
Rotatable bonds 0
PSA 221.6
RO5 violations 1
RO3 violations 3
Refractivity 42.9618
Atoms 25
Rings 0
Heavy atoms 13
Hydrogen atoms 12
Heteroatoms 11
N/O atoms 10
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 1
Cis/trans stereo double bonds 0
Unknown stereo double bonds 1
Undefined stereo double bonds 0
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