p-aminomethyl-nitrobenzene
- CAS:
- Other names:
- SMILES: NCc1ccc(cc1)[N+]([O-])=O
Properties
| MW |
HBA |
HBD |
LogP |
TPSA |
Rot. |
Comp. |
Fsp3C |
Brutto formula |
| 152.15 |
2 |
1 |
2.28 |
71.84 |
2 |
40 |
0.14 |
C7H8N2O2 |
Availability
| Suppliers |
Supplier IDs |
Storage |
Storage ID |
Quantity |
Class |
Added |
|
|
|
SF_C1200 |
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).[p-aminomethyl-nitrobenzene] |
3.03 |
1.90 |
6.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [b-Cyclodextrin](1).[p-aminomethyl-nitrobenzene] |
2.90 |
1.90 |
8.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [b-Cyclodextrin](1).[p-aminomethyl-nitrobenzene] |
2.75 |
1.78 |
11.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [mono-(6-amino-6-deoxy)-b-CD](1).[p-aminomethyl-nitrobenzene] |
2.28 |
1.90 |
6.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [mono-(6-amino-6-deoxy)-b-CD](1).[p-aminomethyl-nitrobenzene] |
2.32 |
1.90 |
8.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [mono-(6-amino-6-deoxy)-b-CD](1).[p-aminomethyl-nitrobenzene] |
2.71 |
1.78 |
11.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [mono-(6-N,N-dimethylamino-6-deoxy)-b-CD](1).[p-aminomethyl-nitrobenzene] |
2.78 |
1.78 |
6.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [mono-(6-N,N-dimethylamino-6-deoxy)-b-CD](1).[p-aminomethyl-nitrobenzene] |
2.84 |
1.95 |
8.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [mono-(6-N,N-dimethylamino-6-deoxy)-b-CD](1).[p-aminomethyl-nitrobenzene] |
3.13 |
2.00 |
11.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [mono-6-(2-aminoethyl)-amino-6-deoxy-b-CD](1).[p-aminomethyl-nitrobenzene] |
2.77 |
1.78 |
6.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [mono-6-(2-aminoethyl)-amino-6-deoxy-b-CD](1).[p-aminomethyl-nitrobenzene] |
2.80 |
1.70 |
8.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [mono-6-(2-aminoethyl)-amino-6-deoxy-b-CD](1).[p-aminomethyl-nitrobenzene] |
2.74 |
1.85 |
11.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [mono-6-(2-N,N-dimethylaminoethyl)-amino-6-deoxy-b-CD](1).[p-aminomethyl-nitrobenzene] |
2.79 |
1.85 |
6.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [mono-6-(2-N,N-dimethylaminoethyl)-amino-6-deoxy-b-CD](1).[p-aminomethyl-nitrobenzene] |
2.81 |
1.70 |
8.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |
| [mono-6-(2-N,N-dimethylaminoethyl)-amino-6-deoxy-b-CD](1).[p-aminomethyl-nitrobenzene] |
2.85 |
1.95 |
11.0 |
25.0 |
UV-vis spectroscopy |
Renato Noto 2002 |