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P-580401686

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Name File
SDF P-580401686.sdf
SMILES P-580401686.smiles
Standard InChI P-580401686.inchi
InChIKey P-580401686.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability
P-580401686 Debye Scientific General Catalog 95 by resynthesis (? - ? days)
Property Value
Components 1
Mass 87.164
logP 1.6915
H-bond acceptors 1
H-bond donors 1
Rotatable bonds 1
PSA 26.02
RO5 violations 0
RO3 violations 0
Refractivity 28.5964
Atoms 19
Rings 0
Heavy atoms 6
Hydrogen atoms 13
Heteroatoms 1
N/O atoms 1
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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