Isophthalic acid
Catalog No: FT-0627450
CAS No: 121-91-5
- Molecular Formula: 166.13
- Formula Weight: C8H6O4
- Inchl Key: QQVIHTHCMHWDBS-UHFFFAOYSA-N
- Inchl: InChI=1S/C8H6O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)(H,11,12)
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| FW: | 166.131 |
|---|---|
| CAS: | 121-91-5 |
| Melting_Point: | 341-343 °C(lit.) |
| Bolling_Point: | 412.3±28.0 °C at 760 mmHg |
| MF: | C8H6O4 |
| Product_Name: | Isophthalic acid |
| Flash_Point: | 217.3±20.5 °C |
| Density: | 1.5±0.1 g/cm3 |
| FW: | 166.131 |
|---|---|
| MF: | C8H6O4 |
| Water_Solubility: | 0.01 g/100 mL (25 ºC) |
| Flash_Point: | 217.3±20.5 °C |
| Refractive_Index: | 1.618 |
| Bolling_Point: | 412.3±28.0 °C at 760 mmHg |
| Exact_Mass: | 166.026611 |
| PSA: | 74.60000 |
| Computational_Chemistry: | ['1 . XlogP 17 ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 4 ', '4 . Rotatable Bond Count 2 ', '5 . Isotope Atom Count ', '6 . TPSA 746 ', '7 . Heavy Atom Count 12 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 179 ', '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'] |
| Vapor_Pressure: | 0.0±1.0 mmHg at 25°C |
| LogP: | 1.66 |
| Melting_Point: | 341-343 °C(lit.) |
| Density: | 1.5±0.1 g/cm3 |
| More_Info: | ['1 . Appearance White 结晶粉末or 粉末结晶 ', '2 . Melting point（ºC）348 ', '3 . Solubility 易Soluble in Ethanol 丙酮and 冰醋酸，微Soluble in 沸Water ，难Soluble in 冷Water ，几乎Insoluble in 苯and 石油醚。 ', '4 气相标准. Combustion heat(焓)(kJ·mol-1)-33091 ', '5 气相标准声称热(焓)( kJ·mol-1) -6962 ', '6 晶相相标准. Combustion heat(焓)(kJ·mol-1)-32026 ', '7 晶相标准声称热(焓)( kJ·mol-1)-80299'] |
| Personal_Protective_Equipment: | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
|---|---|
| RTECS: | NT2007000 |
| HS_Code: | 29173980 |
| Safety_Statements: | S24/25-S36-S26 |
| WGK_Germany: | 2 |
| RIDADR: | NONH for all modes of transport |
| Risk_Statements(EU): | R36/37/38 |
| Hazard_Codes: | Xi:Irritant |
