m-nitrophenyl isonicotinate
- CAS:
- Other names: MNPIN
- SMILES: [O-][N+](=O)c1cccc(OC(=O)c2ccncc2)c1
Properties
| MW |
HBA |
HBD |
LogP |
TPSA |
Rot. |
Comp. |
Fsp3C |
Brutto formula |
| 244.20 |
4 |
0 |
2.73 |
85.01 |
4 |
81 |
0.00 |
C12H8N2O4 |
Availability
| Suppliers |
Supplier IDs |
Storage |
Storage ID |
Quantity |
Class |
Added |
|
|
|
JN_64 |
None |
|
Jan. 1, 2023 |
Bar codes
| Plate barcode |
Sample barcode |
|
|
PAINS
| Identified PAINS |
| Not checked |
Supramolecules
| Name | log K | SD | pH | T(°C) | Method | Ref |
| [a-Cyclodextrin](1).[m-nitrophenyl isonicotinate] |
1.95 |
|
9.5 |
25.0 |
NMR spectroscopy |
Paolo Scrimin 1997 |
| [b-Cyclodextrin](1).[m-nitrophenyl isonicotinate] |
2.20 |
|
9.5 |
25.0 |
NMR spectroscopy |
Paolo Scrimin 1997 |