3-Thiophenemalonic acid
Catalog No: FT-0616410
CAS No: 21080-92-2
- Molecular Formula: 184.17
- Formula Weight: C7H4O4S-2
- Inchl Key: GCOOGCQWQFRJEK-UHFFFAOYSA-L
- Inchl: InChI=1S/C7H6O4S/c8-6(9)5(7(10)11)4-1-2-12-3-4/h1-3,5H,(H,8,9)(H,10,11)/p-2
| Assay | Pack | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Symbol: | GHS07 |
|---|---|
| CAS: | 21080-92-2 |
| Flash_Point: | 193.8±25.1 °C |
| Product_Name: | 3-Thienylmalonic acid |
| Bolling_Point: | 396.8±32.0 °C at 760 mmHg |
| FW: | 186.185 |
| Melting_Point: | 139 °C (dec.)(lit.) |
| MF: | C7H6O4S |
| Density: | 1.6±0.1 g/cm3 |
| Refractive_Index: | 1.628 |
|---|---|
| Vapor_Pressure: | 0.0±1.0 mmHg at 25°C |
| Flash_Point: | 193.8±25.1 °C |
| LogP: | 1.13 |
| Bolling_Point: | 396.8±32.0 °C at 760 mmHg |
| FW: | 186.185 |
| PSA: | 102.84000 |
| Computational_Chemistry: | ['1. XlogP :09 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :3 ', '5. Isotope Atom Count :N/A ', '6. TPSA 103 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :190 ', '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: | 139 °C (dec.)(lit.) |
| MF: | C7H6O4S |
| Exact_Mass: | 185.998672 |
| Molecular_Structure: | ['1 . Molar refractive index 4195 ', '2 . Molar volume (m3/mol)1182 ', '3 . Parachor (902K)3490 ', '4 表面张力(dyne/cm)759 ', '5 . Polarizability (10-24cm3)1663'] |
| Density: | 1.6±0.1 g/cm3 |
| More_Info: | ['1. Appearance White 结晶。 ', '2. Density（g/mL,25/4℃）Unknow ', '3. Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4. Melting point（ºC ）;127-130 ', '5. Boiling point（ºC,Atmospheric pressure）Unknow ', '6. Boiling point（ºC,52kPa）Unknow ', '7. Refractive indexUnknow ', '8. Flash point（ºC）Unknow ', '9. Specific rotation（º）Unknow ', '10. Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11. Vapor pressure（kPa,25ºC）Unknow ', '12. Saturated vapor pressure（kPa,60ºC）Unknow ', '13. Combustion heat（KJ/mol）Unknow ', '14. Critical temperature（ºC）Unknow ', '15. Critical pressure（KPa）Unknow ', '16. Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17. Upper limit of explosion（%,V/V）Unknow ', '18. Lower limit of explosion（%,V/V）Unknow ', '19. Solubility Unknow'] |
| Symbol: | GHS07 |
|---|---|
| Risk_Statements(EU): | R36/37/38:Irritating to eyes, respiratory system and skin . |
| HS_Code: | 2942000000 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
| RIDADR: | NONH for all modes of transport |
| Hazard_Codes: | Xi |
| Warning_Statement: | P261-P305 + P351 + P338 |
| Safety_Statements: | H315-H319-H335 |
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