4-({4-[(2-Fluorophenyl)Amino]-2-Pyrimidinyl}Amino)Benzoic Acid
Properties
Property | Value |
---|---|
Formula | C17H13FN4O2 |
IUPAC Name | 4-[[4-(2-fluoroanilino)pyrimidin-2-yl]amino]benzoic acid |
Molecular Mass | 324.309 g·mol−1 |
Heat of Formation | -180.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.22 ± 1.08 D |
Volume | 360.46 Å 3 |
Surface Area | 334.53 Å 2 |
HOMO Energy | -8.96 ± 0.55 eV |
LUMO Energy | 2.06 ± eV |
Point Group Symmetry | C1 |
InChIKey | DSRXYFSONVBAKS-UHFFFAOYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C N O F |