![5-CHLORO-3-METHYL-1H-BENZO[B]THIOPHENE-1,1-DIONE (CAS: 17514-66-8) - Chemical Structure and Molecular Formula](/static/img/prod_pic/FT-0620289.png "5-CHLORO-3-METHYL-1H-BENZO[B]THIOPHENE-1,1-DIONE chemical structure")
5-CHLORO-3-METHYL-1H-BENZO[B]THIOPHENE-1,1-DIONE
Catalog No: FT-0620289
CAS No: 17514-66-8
- Chemical Name: 5-CHLORO-3-METHYL-1H-BENZO[B]THIOPHENE-1,1-DIONE
- Molecular Formula: C9H7ClO2S
- Molecular Weight: 214.67
- InChI Key: GYZFDGWHPWNEKL-UHFFFAOYSA-N
- InChI: InChI=1S/C9H7ClO2S/c1-6-5-13(11,12)9-3-2-7(10)4-8(6)9/h2-5H,1H3
| Assay | Pack Size | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Product_Name: | 5-chloro-3-methyl-1-benzothiophene 1,1-dioxide |
|---|---|
| Flash_Point: | 194.2ºC |
| Melting_Point: | 168ºC |
| FW: | 214.66900 |
| Density: | 1.447g/cm3 |
| CAS: | 17514-66-8 |
| Bolling_Point: | 397.4ºC at 760mmHg |
| MF: | C9H7ClO2S |
| Molecular_Structure: | ['1 . Molar refractive index 5191 ', '2 . Molar volume （m3/mol）1483 ', '3 . Parachor （902K）3932 ', '4 . Surface tension 493 ', '5 . Polarizability 2058'] |
|---|---|
| LogP: | 3.56890 |
| Flash_Point: | 194.2ºC |
| Refractive_Index: | 1.617 |
| FW: | 214.66900 |
| Density: | 1.447g/cm3 |
| Bolling_Point: | 397.4ºC at 760mmHg |
| Computational_Chemistry: | ['1. XlogP :18 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 425 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :339 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| Melting_Point: | 168ºC |
| PSA: | 42.52000 |
| MF: | C9H7ClO2S |
| More_Info: | ['1 . Appearance 不确定 ', '2 . Density（g/mL,25/4℃）不确定 ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting point（ºC）168 ', '5 . Boiling point（ºC,Atmospheric pressure）不确定 ', '6 . Boiling point（ºC, 52kPa）不确定 ', '7 . Refractive index不确定 ', '8 . Flash point（ºC）不确定 ', '9 . Specific rotation（º）不确定 ', '10 . Spontaneous ignition point or ignition temperature（ºC）不确定 ', '11 . Vapor pressure（kPa,25ºC）不确定 ', '12 . Saturated vapor pressure（kPa,60ºC）不确定 ', '13 . Combustion heat（KJ/mol）不确定 ', '14 . Critical temperature（ºC）不确定 ', '15 . Critical pressure（KPa）不确定 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion（%,V/V）不确定 ', '18 . Lower limit of explosion（%,V/V）不确定 ', '19 . Solubility 不确定'] |
| Vapor_Pressure: | 3.64E-06mmHg at 25°C |
| Exact_Mass: | 213.98600 |
| Hazard_Codes: | Xi: Irritant; |
|---|---|
| HS_Code: | 2934999090 |
Related Products
3,4-Pyrrolidinediol, 2-[(4-methoxyphenyl)methyl]-, 3-acetate, (2S,3R,4R)-
(4S)-2-[[[(2R)-2-AMino-2-(4-hydroxyphenyl)acetyl]aMino]Methyl]-5,5-diMethyl-4-thiazolidinecarboxylic Acid (Mixture of DiastereoMers)