2-[1-Hydroxy-2-(Trimethylammonio)Ethyl]-3-Oxo-6-Heptenoate
Properties
| Property | Value |
|---|---|
| Formula | C12H21NO4 |
| IUPAC Name | (2r)-2-[(1s)-1-hydroxy-2-(trimethylammonio)ethyl]-3-oxo-hept-6-enoate |
| Molecular Mass | 243.299 g·mol−1 |
| Heat of Formation | -638.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 13.93 ± 1.08 D |
| Volume | 308.88 Å 3 |
| Surface Area | 275.42 Å 2 |
| HOMO Energy | -8.76 ± 0.55 eV |
| LUMO Energy | 2.57 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PORPGMPMXKKUMS-MNOVXSKESA-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 |