6-{5-[(2,4-Diamino-5-Pyrimidinyl)Methyl]-2,3-Dimethoxyphenyl}-5-Hexynoic Acid
Properties
Property | Value |
---|---|
Formula | C19H22N4O4 |
IUPAC Name | 6-[5-[(2,4-diaminopyrimidin-5-yl)methyl]-2,3-dimethoxy-phenyl]hex-5-ynoic acid |
Molecular Mass | 370.402 g·mol−1 |
Heat of Formation | -342.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.82 ± 1.08 D |
Volume | 443.09 Å 3 |
Surface Area | 364.04 Å 2 |
HOMO Energy | -8.67 ± 0.55 eV |
LUMO Energy | 2.80 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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InChIKey | JAGSWKLZBKKKJP-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 N |