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K 18500
CAS: 55965-84-9 | C8H9ClN2O2S2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
55965-84-9
Molecular Formula:
C8H9ClN2O2S2
Molecular Weight:
264.759 g/mol
Names and Synonyms:
K 18500
Synonym
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
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
Identifiers:
SMILES:
Cn1sc(Cl)cc1=O.Cn1sccc1=O
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
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
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.
All Properties
Comprehensive physical and chemical properties
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 264.759 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 263.979397208 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 15 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 6 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 2 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 44.0 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 1.5470000000000002 | RDKit |
| molecular_mass | 264.76 g/mol | Legacy Database |
| cas-canonical-smile | O=C1C=CSN1C.O=C1C=C(Cl)SN1C None | Legacy Database |
| cas-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 None | Legacy Database |
| cas-inchi-key | InChIKey=QYYMDNHUJFIDDQ-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Kathon None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 64.13000000000001 | RDKit |