| Formula |
C15H18O3S |
| IUPAC Name |
methyl 7-isopropyl-4-methyl-azulene-1-sulfonate |
| Molecular Mass |
278.367 g·mol−1 |
| Heat of Formation |
-312.9 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.89 ± 1.08 D |
| Volume |
330.8 Å 3 |
| Surface Area |
292.86 Å 2 |
| HOMO Energy |
-8.69 ± 0.55 eV |
| LUMO Energy |
-1.45 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 1,4-dimethyl-7-(1-methylethyl)-azulenesulfonic acid
- 7-isopropyl-4-methyl-1-azulenesulfonic acid methyl ester
- 7-isopropyl-4-methyl-azulene-1-sulfonic acid methyl ester
- azulenesulfonic acid, 1,4-dimethyl-7-(1-methylethyl)-
- guaiazulene sulfonic acid
- hachi-azule n
- methyl 4-methyl-7-propan-2-yl-azulene-1-sulfonate
- methyl 4-methyl-7-propan-2-ylazulene-1-sulfonate
|
| CAS Number(s) |
|
| InChIKey |
YCNOCVINSKLZHY-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
|
| Downloads |
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|
| Elements |
H
S
C
O
|
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