3-(4-Ethylbenzoyl)benzoic acid anion
- CAS:
- Other names:
- SMILES: O=C([O-])C1=CC=CC(C(C2=CC=C(CC)C=C2)=O)=C1
Properties
| MW |
HBA |
HBD |
LogP |
TPSA |
Rot. |
Comp. |
Fsp3C |
Brutto formula |
| 253.27 |
2 |
0 |
1.84 |
57.199999999999996 |
4 |
43 |
0.13 |
C16H13O3- |
Availability
| Suppliers |
Supplier IDs |
Storage |
Storage ID |
Quantity |
Class |
Added |
|
|
|
nt1274 |
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 |
| [b-Cyclodextrin](1).[3-(4-Ethylbenzoyl)benzoic acid anion] |
3.12 |
|
|
25.0 |
|
Kenneth A. Connors 1995 |