| Formula |
C13H14O4S |
| IUPAC Name |
5,6-diethoxybenzothiophene-2-carboxylic acid |
| Molecular Mass |
266.313 g·mol−1 |
| Heat of Formation |
-572.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.38 ± 1.08 D |
| Volume |
302.8 Å 3 |
| Surface Area |
286.82 Å 2 |
| HOMO Energy |
-8.65 ± 0.55 eV |
| LUMO Energy |
-1.10 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 5,6-diethoxy-2-benzothiophenecarboxylic acid
- 5,6-diethoxybenzo(b)thiophene-2-carboxylic acid
- benzo(b)thiophene-2-carboxylic acid, 5,6-diethoxy-
- ly 186655
- tibenclast
- tibenelast
- tibenelastum [latin]
|
| CAS Number(s) |
|
| InChIKey |
PDUXMHXBBXXJFQ-UHFFFAOYSA-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
|
| |
|
