4-(BROMOMETHYL)-3-NITROBENZOIC ACID
Catalog No: FT-0620694
CAS No: 20782-91-6
- Molecular Formula: 205.99
- Formula Weight: C5H4BrNO3
- Inchl Key: CPZOCLCUJQJRBN-UHFFFAOYSA-N
- Inchl: InChI=1S/C5H4BrNO3/c6-3-4-1-2-5(10-4)7(8)9/h1-2H,3H2
| 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: | Warning |
|---|---|
| FW: | 205.99400 |
| Density: | 1.813g/cm3 |
| CAS: | 20782-91-6 |
| Bolling_Point: | 277.8ºC at 760 mmHg |
| Product_Name: | 4-(bromomethyl)-3-nitrobenzoic acid |
| Melting_Point: | 45-47ºC(lit.) |
| Flash_Point: | 121.8ºC |
| MF: | C5H4BrNO3 |
| Molecular_Structure: | ['1 . Molar refractive index 3774 ', '2 . Molar volume (m3/mol)1135 ', '3 . Parachor (902K)3056 ', '4 表面张力(dyne/cm)525 ', '5 . Polarizability (10-24cm3)1496'] |
|---|---|
| Flash_Point: | 121.8ºC |
| Refractive_Index: | 1.579 |
| FW: | 205.99400 |
| Density: | 1.813g/cm3 |
| Bolling_Point: | 277.8ºC at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 59 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :135 ', '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'] |
| LogP: | 2.60590 |
| Melting_Point: | 45-47ºC(lit.) |
| PSA: | 58.96000 |
| MF: | C5H4BrNO3 |
| More_Info: | ['1. Appearance Unknow ', '2. Density（g/mL,25/4℃）Unknow ', '3. Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4. Melting point（ºC）45-47 ', '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'] |
| Vapor_Pressure: | 0.00749mmHg at 25°C |
| Exact_Mass: | 204.93700 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Faceshields;Gloves |
|---|---|
| Hazard_Codes: | C: Corrosive;Xn: Harmful; |
| Risk_Statements(EU): | 34-43-36-22 |
| Safety_Statements: | 26-36/37/39-45-36/37 |
| Symbol: | Warning |
| Warning_Statement: | P280-P305 + P351 + P338 |
| RIDADR: | UN 3261 8/PG 2 |
| HS_Code: | 2932190090 |
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