3-Chloro-2,2-dimethyl-1-propanol
Catalog No: FT-0636886
CAS No: 13401-56-4
- Chemical Name: 3-Chloro-2,2-dimethyl-1-propanol
- Molecular Formula: C5H11ClO
- Molecular Weight: 122.59
- InChI Key: CAZPRAORHCOIHC-UHFFFAOYSA-N
- InChI: InChI=1S/C5H11ClO/c1-5(2,3-6)4-7/h7H,3-4H2,1-2H3
| 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 |
| Melting_Point: | 34-36 °C(lit.) |
|---|---|
| CAS: | 13401-56-4 |
| MF: | C5H11ClO |
| Flash_Point: | 71.1±0.0 °C |
| Product_Name: | 3-Chloro-2,2-dimethyl-1-propanol |
| Density: | 1.0±0.1 g/cm3 |
| FW: | 122.593 |
| Bolling_Point: | 163.5±0.0 °C at 760 mmHg |
| Refractive_Index: | 1.439 |
|---|---|
| Vapor_Pressure: | 0.7±0.6 mmHg at 25°C |
| Flash_Point: | 71.1±0.0 °C |
| LogP: | 1.20 |
| Bolling_Point: | 163.5±0.0 °C at 760 mmHg |
| FW: | 122.593 |
| PSA: | 20.23000 |
| Computational_Chemistry: | ['1. XlogP :13 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :7 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :52 ', '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: | 34-36 °C(lit.) |
| MF: | C5H11ClO |
| Exact_Mass: | 122.049843 |
| Molecular_Structure: | ['1 . Molar refractive index 3156 ', '2 . Molar volume （m3/mol）1200 ', '3 . Parachor （902K）2813 ', '4 . Surface tension 302 ', '5 . Polarizability 1251'] |
| Density: | 1.0±0.1 g/cm3 |
| 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）34-36 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,52kPa）87 ', '7 . Refractive indexn 20/D 145 ', '8 . Flash point（ºC）711 ', '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'] |
| Risk_Statements(EU): | R36/37/38 |
|---|---|
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| RIDADR: | NONH for all modes of transport |
| Safety_Statements: | S26-S36/37/39 |
| HS_Code: | 2905590090 |
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