| Formula |
C4H5NOS |
| IUPAC Name |
2-methylisothiazol-3-one |
| Molecular Mass |
115.154 g·mol−1 |
| Heat of Formation |
-48.6 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.65 ± 1.08 D |
| Volume |
129.81 Å 3 |
| Surface Area |
137.71 Å 2 |
| HOMO Energy |
-8.68 ± 0.55 eV |
| LUMO Energy |
-1.33 ± eV |
| Point Group Symmetry |
Cs
|
| Synonyms
|
- 2-methyl-1,2-thiazol-3-one
- 2-methyl-2h-isothiazol-3-one
- 2-methyl-3(2h)-isothiazolone
- 2-methyl-3-isothiazolone
- 2-methyl-4-isothiazolin-3-one
- 3(2h)-isothiazolone, 2-methyl-
- ls-86324
|
| CAS Number(s) |
|
| InChIKey |
BEGLCMHJXHIJLR-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
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|
| DOI |
|
| Downloads |
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|
| Elements |
H
S
C
O
N
|
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