5-[(3R)-3-(5-Methoxy-2',6'-Dimethyl-3-Biphenylyl)-1-Butyn-1-Yl]-6-Methyl-2,4-Pyrimidinediamine
Properties
Property | Value |
---|---|
Formula | C24H26N4O |
IUPAC Name | 5-[(3r)-3-[3-(2,6-dimethylphenyl)-5-methoxy-phenyl]but-1-ynyl]-6-methyl-pyrimidine-2,4-diamine |
Molecular Mass | 386.489 g·mol−1 |
Heat of Formation | 200.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 0.92 ± 1.08 D |
Volume | 496.76 Å 3 |
Surface Area | 414.64 Å 2 |
HOMO Energy | -8.45 ± 0.55 eV |
LUMO Energy | 3.01 ± eV |
Point Group Symmetry | C1 |
InChIKey | XZXVRKHUCSXVBM-AWEZNQCLSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |