4-({4-[(2-Bromophenyl)Amino]-2-Pyrimidinyl}Amino)Benzoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C17H13BrN4O2 |
| IUPAC Name | 4-[[4-(2-bromoanilino)pyrimidin-2-yl]amino]benzoic acid |
| Molecular Mass | 385.215 g·mol−1 |
| Heat of Formation | 22.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.29 ± 1.08 D |
| Volume | 381.77 Å 3 |
| Surface Area | 349.01 Å 2 |
| HOMO Energy | -8.96 ± 0.55 eV |
| LUMO Energy | 2.07 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NCXZWZMYZVWHNN-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O Br N |