Formula |
C4H4ClNOS |
IUPAC Name |
5-chloro-2-methyl-isothiazol-3-one |
Molecular Mass |
149.599 g·mol−1 |
Heat of Formation |
-65.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.15 ± 1.08 D |
Volume |
151.34 Å 3 |
Surface Area |
157.38 Å 2 |
HOMO Energy |
-8.93 ± 0.55 eV |
LUMO Energy |
-1.64 ± eV |
Point Group Symmetry |
Cs
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Synonyms
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- 3(2h)-isothiazolone, 5-chloro-2-methyl-
- 4-isothiazolin-3-one, 5-chloro-2-methyl-
- 5-chloro-2-methyl-1,2-thiazol-3-one
- 5-chloro-2-methyl-2h-isothiazol-3-one
- 5-chloro-2-methyl-3(2h)-isothiazolone
- 5-chloro-2-methyl-3-isothiazolone
- 5-chloro-2-methyl-4-isothiazolin-3-one
- 5-chloro-2-methyl-4-isothiazolin-3-one solution
- kathon cg 5243
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CAS Number(s) |
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InChIKey |
DHNRXBZYEKSXIM-UHFFFAOYSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
C
Cl
H
O
N
S
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