(3aS,4R,5R,7aR)-2,2-dimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxole-4,5-diol
Catalog No: FT-0700828
CAS No: 130669-76-0
- Chemical Name: (3aS,4R,5R,7aR)-2,2-dimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxole-4,5-diol
- Molecular Formula: C9H14O4
- Molecular Weight: 186.20
- InChI Key: VCIXQRISGLSULF-WCTZXXKLSA-N
- InChI: InChI=1S/C9H14O4/c1-9(2)12-6-4-3-5(10)7(11)8(6)13-9/h3-8,10-11H,1-2H3/t5-,6-,7-,8-/m1/s1
| 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: | 313.5ºC at 760mmHg |
|---|---|
| CAS: | 130669-76-0 |
| MF: | C9H14O4 |
| Density: | 1.254g/cm3 |
| Melting_Point: | 68-71ºC(lit.) |
| Product_Name: | (3aS,4R,5R,7aR)-2,2-dimethyl-3a,4,5,7a-tetrahydro-1,3-benzodioxole-4,5-diol |
| Flash_Point: | 143.4ºC |
| FW: | 186.20500 |
| MF: | C9H14O4 |
|---|---|
| Density: | 1.254g/cm3 |
| Computational_Chemistry: | ['1. XlogP :-05 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 589 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :236 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :4 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| Exact_Mass: | 186.08900 |
| Vapor_Pressure: | 0mmHg at 25°C |
| Flash_Point: | 143.4ºC |
| PSA: | 58.92000 |
| Molecular_Structure: | ['五分子性质数据 ', '1 . Molar refractive index 4565 ', '2 . Molar volume 1484 ', '3 . Parachor （902K）3861 ', '4 . Surface tension 457 ', '5 . Polarizability 1809'] |
| Melting_Point: | 68-71ºC(lit.) |
| Bolling_Point: | 313.5ºC at 760mmHg |
| FW: | 186.20500 |
| Refractive_Index: | 1.527 |
| Personal_Protective_Equipment: | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
|---|---|
| WGK_Germany: | 3 |
| RIDADR: | NONH for all modes of transport |
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