P-489210945
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Name | File |
---|---|
SDF | P-489210945.sdf |
SMILES | P-489210945.smiles |
Standard InChI | P-489210945.inchi |
InChIKey | P-489210945.txt |
mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
---|---|---|---|---|---|
P-489210945 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | in stock |
Property | Value |
---|---|
Components | 2 |
Mass | 197.972 |
logP | 1.6325 |
H-bond acceptors | 2 |
H-bond donors | 0 |
Rotatable bonds | 1 |
PSA | 8.81 |
RO5 violations | 0 |
RO3 violations | 0 |
Refractivity | 44.278 |
Atoms | 24 |
Rings | 1 |
Heavy atoms | 13 |
Hydrogen atoms | 11 |
Heteroatoms | 7 |
N/O atoms | 2 |
Inorganic atoms | 0 |
Halogen atoms | 4 |
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 |