5-Pyrazolecarboxylic acid
Catalog No: FT-0647740
CAS No: 1621-91-6
- Chemical Name: 5-Pyrazolecarboxylic acid
- Molecular Formula: C4H4N2O2
- Molecular Weight: 112.09
- InChI Key: KOPFEFZSAMLEHK-UHFFFAOYSA-N
- InChI: InChI=1S/C4H4N2O2/c7-4(8)3-1-2-5-6-3/h1-2H,(H,5,6)(H,7,8)
| 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 |
| Bolling_Point: | 417.1±18.0 °C at 760 mmHg |
|---|---|
| CAS: | 1621-91-6 |
| MF: | C4H4N2O2 |
| Melting_Point: | 211ºC |
| Symbol: | Warning |
| Density: | 1.5±0.1 g/cm3 |
| FW: | 112.087 |
| Product_Name: | 3-Carboxy-1H-pyrazole |
| Flash_Point: | 206.1±21.2 °C |
| Bolling_Point: | 417.1±18.0 °C at 760 mmHg |
|---|---|
| Vapor_Pressure: | 0.0±1.0 mmHg at 25°C |
| LogP: | -0.21 |
| More_Info: | ['1 . Appearance White 粉末。 ', '2 . Density(g/mL,25/4℃) Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)211 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC,52kPa) Unknow ', '7 . Refractive index Unknow ', '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'] |
| Computational_Chemistry: | ['1. XlogP :01 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :4 ', '6. TPSA 66 ', '7. Heavy Atom Count :8 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :104 ', '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: | 211ºC |
| Exact_Mass: | 112.027275 |
| MF: | C4H4N2O2 |
| Density: | 1.5±0.1 g/cm3 |
| Refractive_Index: | 1.617 |
| PSA: | 65.98000 |
| Flash_Point: | 206.1±21.2 °C |
| Molecular_Structure: | ['1 . Molar refractive index 2570 ', '2 . Molar volume (m3/mol)735 ', '3 . Parachor (902K)2231 ', '4 . Surface tension 849 ', '5 . Polarizability (10 -24cm 3)1019'] |
| FW: | 112.087 |
| Symbol: | Warning |
|---|---|
| Safety_Statements: | H315 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
| RIDADR: | NONH for all modes of transport |
| Hazard_Codes: | Xi: Irritant; |
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