Formula |
C9H13NO6S |
IUPAC Name |
4-[(2r)-2-acetamido-2-carboxy-ethyl]sulfanyl-2-oxo-butanoic acid |
Molecular Mass |
263.268 g·mol−1 |
Heat of Formation |
-1094.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.44 ± 1.08 D |
Volume |
299.8 Å 3 |
Surface Area |
277.22 Å 2 |
HOMO Energy |
-9.12 ± 0.55 eV |
LUMO Energy |
-0.45 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 4-[(2r)-2-acetamido-3-hydroxy-3-oxo-propyl]sulfanyl-2-oxo-butanoic acid
- 4-[(2r)-2-acetamido-3-hydroxy-3-oxopropyl]sulfanyl-2-oxobutanoic acid
- 4-[[(2r)-2-acetamido-3-hydroxy-3-keto-propyl]thio]-2-keto-butyric acid
- 4-[[(2r)-2-acetamido-3-hydroxy-3-oxopropyl]thio]-2-oxobutanoic acid
|
InChIKey |
AHFWWWFNCBRMIV-LURJTMIESA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
S
C
O
N
|
|
|