| Formula |
C16H16N2O4 |
| IUPAC Name |
5-nitro-2-(3-phenylpropylamino)benzoic acid |
| Molecular Mass |
300.309 g·mol−1 |
| Heat of Formation |
-275.5 ± 16.7 kJ·mol−1 |
| Dipole Moment |
7.42 ± 1.08 D |
| Volume |
348.0 Å 3 |
| Surface Area |
325.79 Å 2 |
| HOMO Energy |
-9.28 ± 0.55 eV |
| LUMO Energy |
-1.03 ± eV |
| Point Group Symmetry |
Cs
|
| Synonyms
|
- (nppb)
- 2-phenpropylamino-5-nitrobenzoic acid
- 5 nitro 2 (3 phenylpropylamino)benzoic acid
- benzoic acid, 5-nitro-2-((3-phenylpropyl)amino)-
- bio1_000124
- bio1_000613
- bio1_001102
- brit j pharmacol 117: 175 (1996)
- cbiol_001838
- nppb
- tocris-0593
|
| CAS Number(s) |
|
| InChIKey |
WBSMIPAMAXNXFS-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
O
N
|
| |
|
