Formula |
C12H12FNO7 |
IUPAC Name |
2-[4-[(2s)-2-amino-2-carboxy-ethyl]phenoxy]-2-fluoro-propanedioic acid |
Molecular Mass |
301.225 g·mol−1 |
Heat of Formation |
-1356.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.08 ± 1.08 D |
Volume |
324.45 Å 3 |
Surface Area |
288.08 Å 2 |
HOMO Energy |
-9.80 ± 0.55 eV |
LUMO Energy |
2.33 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 2-[4-[(2s)-2-amino-3-hydroxy-3-keto-propyl]phenoxy]-2-fluoro-malonic acid
- 2-[4-[(2s)-2-amino-3-hydroxy-3-oxo-propyl]phenoxy]-2-fluoro-propanedioic acid
- 2-[4-[(2s)-2-amino-3-hydroxy-3-oxopropyl]phenoxy]-2-fluoropropanedioic acid
|
InChIKey |
AXIAXCQZCZMCQW-QMMMGPOBSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
F
O
N
|
|
|