Formula |
C10H12O2S |
IUPAC Name |
2-isopropylsulfanylbenzoic acid |
Molecular Mass |
196.266 g·mol−1 |
Heat of Formation |
-328.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.80 ± 1.08 D |
Volume |
238.66 Å 3 |
Surface Area |
219.03 Å 2 |
HOMO Energy |
-8.74 ± 0.55 eV |
LUMO Energy |
-0.68 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 2-(isopropylthio)benzoic acid
- 2-propan-2-ylsulfanylbenzoic acid
|
InChIKey |
CHFNTLOTIFQVGQ-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
|
|
|