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  1. InChIKey:
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Name File
SDF P-617703477.sdf
SMILES P-617703477.smiles
Standard InChI P-617703477.inchi
InChIKey P-617703477.txt
mcule product ID Supplier Catalog Guaranteed purity (%) Product matching Availability Updated
P-617703477 Otava Chemical Building Blocks for Prompt Delivery 95 in stock January 15
Property Value
Components 1
Mass 358.417
logP 2.40648
H-bond acceptors 7
H-bond donors 2
Rotatable bonds 8
PSA 133.17
RO5 violations 0
RO3 violations 4
Refractivity 96.1994
Atoms 43
Rings 2
Heavy atoms 25
Hydrogen atoms 18
Heteroatoms 8
N/O atoms 7
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