Back to Search
Kathon
CAS: 55965-84-9 | C8H9ClN2O2S2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 55965-84-9
- Molecular Formula
- C8H9ClN2O2S2
- Molecular Mass
- 264.76 g/mol
Identifiers
CAS Registry Number
55965-84-9
SMILES
Cn1sc(Cl)cc1=O.Cn1sccc1=O
InChI Key
QYYMDNHUJFIDDQ-UHFFFAOYSA-N
InChI
InChI=1S/C4H4ClNOS.C4H5NOS/c1-6-4(7)2-3(5)8-6;1-5-4(6)2-3-7-5/h2H,1H3;2-3H,1H3
Names and Synonyms
- Kathon Synonym
- Isocil (antibacterial) Synonym
- 3(2H)-Isothiazolone, 5-chloro-2-methyl-, mixt. with 2-methyl-3(2H)-isothiazolone Synonym
- 3(2H)-Isothiazolone, 2-methyl-, mixt. contg. Synonym
- Isothiazolinone chloride Synonym
- Kathon 886MW Synonym
- Kathon 886 Synonym
- Kathon LX Synonym
- Kathon biocide Synonym
- Kathon CG Synonym
- KKM 43 Synonym
- Bio-Perge Synonym
- Kathon 886W Synonym
- Kathon RH 886 Synonym
- Kathon WT Synonym
- Amerstat 252 Synonym
- Kathon CG/ICP Synonym
- Slaoff 360 Synonym
- Kathon MWC Synonym
- Zonen F Synonym
- MBC 215 Synonym
- Legend MK Synonym
- Kathon Synonym
- Tret-O-Lite XC 215 Synonym
- ProClin 300 Synonym
- Acticide RS Synonym
- Acticide 14 Synonym
- Kaisong Synonym
- Kathon 886F Synonym
- Microcide III Synonym
- Kathon LX Plus Synonym
- Isocil RW Synonym
- Kathon ICP Synonym
- Somacide RS Synonym
- Kathon CG/ICP II Synonym
- Kathon LX 1.5 Synonym
- A 14 Synonym
- A 14 (antimicrobial) Synonym
- Kathon PFM Synonym
- Nalco 7330 Synonym
- Isocil Synonym
- Kathon LX-SF 25 Synonym
- ProClin 200 Synonym
- Kathon LXE Synonym
- SD 818 Synonym
- 5-Chloro-2-methyl-4-isothiazolin-3-one-2-methyl-4-isothiazolin-3-one mixture Synonym
- LXE Synonym
- Mirecide KW Synonym
- Kathon CG 110 Synonym
- Acticide MV 14 Synonym
- Biocide K 10ME Synonym
- Biocide K 10SG Synonym
- Biocide K Synonym
- Nipacide CI Synonym
- Acticide LG Synonym
- Trelin CT Synonym
- K 18500 Synonym
- Kathon CF 1400 Synonym
- Biocide SMB Synonym
- Canguard CM 14 Synonym
- RS Synonym
- Kathon FP 1.5 Synonym
- Canguard CM 1P5 Synonym
- Hokucide R 150 Synonym
- LH 2 Synonym
- LH 2 (corrosion inhibitor) Synonym
- Nipacide CI 15 Synonym
- Bodoxin Synonym
- Fennosan IT 21 Synonym
- Acticide MV Synonym
- Actocode MV Synonym
- Kathon EDC Synonym
- Kathon LX 1400 Synonym
- RHZL 03 Synonym
- ProClin 150 Synonym
- KS 2 Synonym
- Spectrus NX 1106 Synonym
- TST 25 Synonym
- Zonen FP Synonym
- Sharomix MCI Synonym
- Rocima 625 Synonym
- MV Synonym
- BEK 500 Synonym
- SS 411GY Synonym
- SD 818 (antibacterial) Synonym
- Nipaguard CMB Synonym
- K 10SG Synonym
- Zonen C Synonym
- Kuriverter EC 503 Synonym
- Acticide 5008 Synonym
- Mirecide KW 600 Synonym
- CMIT-MIT mixt. Synonym
- Kordek MIX Synonym
- CIT-MIT 14 Synonym
- JE 120 Synonym
- Odycide B 330 Synonym
- 5-Chloro-2-methyl-4-isothiazolin-3-one-2-methyl-4-isothiazolin-3-one mixt. Synonym
- Nipacide CI 15MV Synonym
- CI 15 Synonym
- Preventol D 7 Synonym
- Chloromethylisothiazolinone-methylisothiazolinone mixt. Synonym
- Methylisothiazolinone-chloromethylisothiazolinone mixt. Synonym
- M 30 Synonym
- M 30 (antibacterial) Synonym
- Bodedex forte Synonym
- Kathon LX-SF Synonym
- HY 606D Synonym
- Hydorol D 15 Synonym
- Alchinol D 15 Synonym
- Nipacide 15TR Synonym
- Euxyl K 120 Synonym
- Kathon LX 150 Synonym
- Nipaguard CG Synonym
- A 04 Synonym
- KY Synonym
- Methylchloroisothiazolinone-methylisothiazolinone mixt. Synonym
- Methylchloroisothiazolinone-methylisothiazolinone mixture Synonym
- CM 10 Synonym
- SupGuard K 15 Synonym
- K 15 Synonym
- SP 1025 Synonym
- Kathon 2 Synonym
- Parmatol A 26 Synonym
- Kathon LXE 1.5 Synonym
- Microker IT Synonym
- CM 1P5 Synonym
- Yisaizuolintong Synonym
- LX 150 Synonym
- CMC Synonym
- Proxel CMC Synonym
- Disco AG Clear L 650 Synonym
- D 7 Synonym
- SP 301B Synonym
- Topcide 1000 Synonym
- CY 1 (antiseptic) Synonym
- CY 1 Synonym
- Rocima 631 Synonym
- Dow 631 Synonym
- DLX 601 Synonym
- K 25 Synonym
- BIM MC 4901 Synonym
- K 18 Synonym
- K 18 (preservative) Synonym
- MC Synonym
- Yongfeng MC Synonym
- JX 515-5 Synonym
- Preventol D 7CF Synonym
- UN 3265 Synonym
- PC 300 Synonym
- M 87 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 264.76 g/mol | CAS Common Chemistry |
| 264.759 g/mol | RDKit | |
| 266.512 g/mol | chempirical lib | |
| Canonical SMILES | O=C1C=CSN1C.O=C1C=C(Cl)SN1C | CAS Common Chemistry |
| InChI | InChI=1S/C4H4ClNOS.C4H5NOS/c1-6-4(7)2-3(5)8-6;1-5-4(6)2-3-7-5/h2H,1H3;2-3H,1H3 | CAS Common Chemistry |
| InChI Key | InChIKey=QYYMDNHUJFIDDQ-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Kathon | CAS Common Chemistry |
| Heavy Atom Count | 15 | RDKit |
| Hydrogen Bond Acceptors | 6 | RDKit |
| 4 | RDKit | |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 2 | RDKit |
| Topological Polar Surface Area | 44.0 Ų | RDKit |
| 40.16 Ų | chempirical lib | |
| LogP | 1.5470000000000002 | RDKit |
| 1.547 | RDKit | |
| Molar Refractivity | 64.13000000000001 cm³/mol | RDKit |
| Ring Count | 2 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.25 | RDKit |
| Exact Mass | 263.979397208 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
