4-({4-[(2-Ethylhexyl)Amino]-4-Oxo-2-Butanyl}Oxy)-4-Oxobutanoic Acid
Properties
Property | Value |
---|---|
Formula | C16H29NO5 |
IUPAC Name | 4-[(1r)-3-[[(2r)-2-ethylhexyl]amino]-1-methyl-3-oxo-propoxy]-4-oxo-butanoic acid |
Molecular Mass | 315.405 g·mol−1 |
Heat of Formation | -1219.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.74 ± 1.08 D |
Volume | 417.12 Å 3 |
Surface Area | 332.02 Å 2 |
HOMO Energy | -9.55 ± 0.55 eV |
LUMO Energy | 0.55 ± eV |
Point Group Symmetry | C1 |
InChIKey | CQONVBIGUJWUFE-CHWSQXEVSA-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 |