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26530-20-1

Name 2-Octyl-2H-isothiazol-3-one
CAS 26530-20-1
EINECS(EC#) 247-761-7
Molecular Formula C11H19NOS
MDL Number MFCD00072473
Molecular Weight 213.34
MOL File 26530-20-1.mol

Chemical Properties

Appearance Yellow solid or clear dark amber liquid.
Melting point  <25 °C
Boiling point  120°C
density  1.04
vapor pressure  4.9hPa at 25℃
refractive index  1.5500 (estimate)
Fp  23℃
storage temp.  Refrigerator
solubility  Chloroform (Slightly), Ethyl Acetate (Slightly)
form  neat
pka -2.04±0.20(Predicted)
color  White or Colorless to Yellow
Stability: Stable. Incompatible with strong oxidizing agents.
Water Solubility  <0.1 g/100 mL at 19 ºC
Usage Fungicide. Antimicrobial agent
Merck  14,6755
BRN  1211137
Contact allergens
This isothiazolinone, contained in relatively few products compared to other isothiazolinones, is used in cleaning and polishing agents, latex paints, stains, adhesives, wood and leather preservatives, metalworking fluids (cutting oils), and plastic manufacture.
InChIKey JPMIIZHYYWMHDT-UHFFFAOYSA-N
LogP 2.61 at 25℃
CAS DataBase Reference 26530-20-1(CAS DataBase Reference)
NIST Chemistry Reference 3(2H)-isothiazolone, 2-octyl-(26530-20-1)
EPA Substance Registry System 26530-20-1(EPA Substance)

Safety Data

Hazard Codes  T;N,N,T
Risk Statements 
R22:Harmful if swallowed.
R23/24:Toxic by inhalation and in contact with skin .
R34:Causes burns.
R43:May cause sensitization by skin contact.
R50/53:Very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
Safety Statements 
S1/2:Keep locked up and out of the reach of children .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S60:This material and/or its container must be disposed of as hazardous waste .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
RIDADR  2922
WGK Germany  3
RTECS  NX8156900
HazardClass  8
PackingGroup  III
HS Code  29341000
Safety Profile
Moderately toxic by ingestion and skin contact. A skin and severe eye irritant. A rmldewcide. When heated to decomposition it emits very toxic fumes of SOx and NOx. See also KETONES.
Hazardous Substances Data 26530-20-1(Hazardous Substances Data)
Toxicity
LD50 orl-rat: 550 mg/kg MosJN# 15AUG79

Hazard Information

Material Safety Data Sheet(MSDS)

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