25103-09-7
Product Name:
ISOOCTYL THIOGLYCOLATE
Formula:
C10H20O2S
Synonyms:
Isooctylthioglycolate;Mercaptoacetic acid isooctyl ester, Isooctyl mercaptoacetate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Liquid |
|---|---|
| Color/Form | Clear, water-white liquid |
| Odor | Faint fruity odor |
| Boiling Point | 125 °C @ 17 mm Hg |
| Density | 0.9736 @ 25 °C |
| Decomposition | When heated to decomposition it emits toxic fumes of sulfoxides. |
| Refractive Index | Index of refraction: 1.4606 @ 21 °C |
| Other Experimental Properties | Acid number is less than 1 |
| Chemical Classes | Other Classes -> Thioglycolates |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07  Environment GHS09 |
| GHS Hazard Statements |
H302:Acute toxicity,oral H317:Sensitisation, Skin H410:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell. P302+P352:IF ON SKIN: wash with plenty of soap and water. |
COMPUTED DESCRIPTORS
| Molecular Weight | 204.33 g/mol |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 8 |
| Exact Mass | 204.11840105 g/mol |
| Monoisotopic Mass | 204.11840105 g/mol |
| Topological Polar Surface Area | 27.3 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 135 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |