3-Phenyl-1H-pyrazole-5-carboxylic acid
Catalog No: FT-0678418
CAS No: 1134-49-2
- Chemical Name: 3-Phenyl-1H-pyrazole-5-carboxylic acid
- Molecular Formula: C10H8N2O2
- Molecular Weight: 188.18
- InChI Key: QBPUOAJBMXXBNU-UHFFFAOYSA-N
- InChI: InChI=1S/C10H8N2O2/c13-10(14)9-6-8(11-12-9)7-4-2-1-3-5-7/h1-6H,(H,11,12)(H,13,14)
| 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 |
| FW: | 188.183 |
|---|---|
| CAS: | 1134-49-2 |
| Flash_Point: | 254.1±25.4 °C |
| MF: | C10H8N2O2 |
| Symbol: | Warning |
| Bolling_Point: | 496.5±33.0 °C at 760 mmHg |
| Melting_Point: | 250 °C |
| Product_Name: | 5-Phenyl-1H-pyrazole-3-carboxylic acid |
| Density: | 1.4±0.1 g/cm3 |
| FW: | 188.183 |
|---|---|
| MF: | C10H8N2O2 |
| Refractive_Index: | 1.645 |
| More_Info: | ['1 . Appearance Unknow ', '2 . Density(g/mL,15℃)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)250 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Refractive indexUnknow ', '7 . Flash point(ºC)Unknow ', '8 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '9 . Specific rotation(º) Unknow ', '10 . Vapor pressure(kPa,25ºC)Unknow ', '11 . Saturated vapor pressure(kPa,60ºC)Unknow ', '12 . Combustion heat(KJ/mol)Unknow ', '13 . Critical temperature(ºC)Unknow ', '14 . Critical pressure(KPa)Unknow ', '15 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient Unknow ', '16 . Upper limit of explosion(%,V/V)Unknow ', '17 . Lower limit of explosion(%,V/V)Unknow ', '18 . Solubility Unknow'] |
| Vapor_Pressure: | 0.0±1.3 mmHg at 25°C |
| Bolling_Point: | 496.5±33.0 °C at 760 mmHg |
| Exact_Mass: | 188.058578 |
| PSA: | 65.98000 |
| Computational_Chemistry: | ['1. XlogP :17 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :4 ', '6. TPSA 66 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :214 ', '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'] |
| Molecular_Structure: | ['1. Molar refractive index 5029 ', '2. Molar volume 1387 ', '3. Parachor (902K)3965 ', '4. Surface tension 666 ', '5. Dielectric constant N/A ', '6. Polarizability 1994 ', '7. Single isotope mass 188058578 Da ', '8. Nominal mass 188 Da ', '9. Average mass 1881827 Da'] |
| LogP: | 1.88 |
| Melting_Point: | 250 °C |
| Flash_Point: | 254.1±25.4 °C |
| Density: | 1.4±0.1 g/cm3 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
|---|---|
| Symbol: | GHS07 |
| WGK_Germany: | 3 |
| Warning_Statement: | P261-P305 + P351 + P338 |
| Safety_Statements: | H315-H319-H335 |
| RIDADR: | NONH for all modes of transport |
| Risk_Statements(EU): | R36/37/38 |
| Hazard_Codes: | Xi |
| HS_Code: | 2933199090 |
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