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P-893679019

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Name File
SDF P-893679019.sdf
SMILES P-893679019.smiles
Standard InChI P-893679019.inchi
InChIKey P-893679019.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-893679019 eNovation Chemicals LLC Building Block on demand 95 by synthesis
Property Value
Components 2
Mass 239.782
logP 4.5494
H-bond acceptors 1
H-bond donors 1
Rotatable bonds 4
PSA 12.03
RO5 violations 0
RO3 violations 2
Refractivity 72.7097
Atoms 38
Rings 2
Heavy atoms 16
Hydrogen atoms 22
Heteroatoms 2
N/O atoms 1
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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