METHYL 3-IODO-4-METHYLBENZOATE
Catalog No: FT-0655859
CAS No: 90347-66-3
- Chemical Name: METHYL 3-IODO-4-METHYLBENZOATE
- Molecular Formula: C9H9IO2
- Molecular Weight: 276.07
- InChI Key: NKMHAOTZPFVSPC-UHFFFAOYSA-N
- InChI: InChI=1S/C9H9IO2/c1-6-3-4-7(5-8(6)10)9(11)12-2/h3-5H,1-2H3
| 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: | Methyl 3-iodo-4-methylbenzoate |
|---|---|
| Flash_Point: | 137.0±24.6 °C |
| Melting_Point: | 93-95ºC |
| FW: | 276.071 |
| Density: | 1.7±0.1 g/cm3 |
| CAS: | 90347-66-3 |
| Bolling_Point: | 302.9±30.0 °C at 760 mmHg |
| MF: | C9H9IO2 |
| Molecular_Structure: | ['1 . Molar refractive index 5575 ', '2 . Molar volume (m3/mol)1656 ', '3 . Parachor (902K)4253 ', '4 表面张力(dyne/cm)434 ', '5 . Polarizability (10-24cm3)2210'] |
|---|---|
| Flash_Point: | 137.0±24.6 °C |
| Refractive_Index: | 1.588 |
| FW: | 276.071 |
| Density: | 1.7±0.1 g/cm3 |
| Bolling_Point: | 302.9±30.0 °C at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :28 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :3 ', '6. TPSA 263 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :170 ', '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: | 3.77 |
| Melting_Point: | 93-95ºC |
| PSA: | 26.30000 |
| MF: | C9H9IO2 |
| More_Info: | ['1 . Appearance Colourless to Yellow 的Liquid ', '2 . Density(g/mL20 ºC)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)93-95 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC18mmHg)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,)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(正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 不能拌and or 难以拌and 于Water '] |
| Vapor_Pressure: | 0.0±0.6 mmHg at 25°C |
| Exact_Mass: | 275.964722 |
| Hazard_Codes: | Xi: Irritant; |
|---|---|
| HS_Code: | 2916399090 |
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