5-NITRO-M-XYLENE-ALPHA,ALPHA'-DIOL
Catalog No: FT-0641335
CAS No: 71176-55-1
- Chemical Name: 5-NITRO-M-XYLENE-ALPHA,ALPHA'-DIOL
- Molecular Formula: C8H9NO4
- Molecular Weight: 183.16
- InChI Key: FTLFITNFXXERLN-UHFFFAOYSA-N
- InChI: InChI=1S/C8H9NO4/c10-4-6-1-7(5-11)3-8(2-6)9(12)13/h1-3,10-11H,4-5H2
| 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 |
| Product_Name: | [3-(hydroxymethyl)-5-nitrophenyl]methanol |
|---|---|
| Flash_Point: | 191.3ºC |
| Melting_Point: | 94-96ºC(lit.) |
| FW: | 183.16100 |
| Density: | 1.42g/cm3 |
| CAS: | 71176-55-1 |
| Bolling_Point: | 421.9ºC at 760 mmHg |
| MF: | C8H9NO4 |
| Molecular_Structure: | ['1 . Molar refractive index 4570 ', '2 . Molar volume 1289 ', '3 . Parachor （902K）3698 ', '4 . Surface tension 677 ', '5 . Polarizability 1811 ', '6 . Dielectric constant 未确定'] |
|---|---|
| LogP: | 1.10260 |
| Flash_Point: | 191.3ºC |
| Refractive_Index: | 1.627 |
| FW: | 183.16100 |
| Density: | 1.42g/cm3 |
| Bolling_Point: | 421.9ºC at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :0 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 863 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :168 ', '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: | 94-96ºC(lit.) |
| PSA: | 86.28000 |
| Exact_Mass: | 183.05300 |
| MF: | C8H9NO4 |
| RIDADR: | NONH for all modes of transport |
|---|---|
| WGK_Germany: | 3 |
