3-chloro-3-methylbut-1-yne
Catalog No: FT-0694615
CAS No: 1111-97-3
- Chemical Name: 3-chloro-3-methylbut-1-yne
- Molecular Formula: C5H7Cl
- Molecular Weight: 102.56
- InChI Key: QSILYWCNPOLKPN-UHFFFAOYSA-N
- InChI: InChI=1S/C5H7Cl/c1-4-5(2,3)6/h1H,2-3H3
| 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 |
| Symbol: | GHS02, GHS07 |
|---|---|
| CAS: | 1111-97-3 |
| Flash_Point: | 4.4±0.0 °C |
| Product_Name: | 3-Chloro-3-methyl-1-butyne |
| Bolling_Point: | 78.0±0.0 °C at 760 mmHg |
| FW: | 102.562 |
| Melting_Point: | −61 °C(lit.) |
| MF: | C5H7Cl |
| Density: | 1.0±0.1 g/cm3 |
| Refractive_Index: | 1.437 |
|---|---|
| Vapor_Pressure: | 104.3±0.1 mmHg at 25°C |
| Flash_Point: | 4.4±0.0 °C |
| LogP: | 1.68 |
| Bolling_Point: | 78.0±0.0 °C at 760 mmHg |
| More_Info: | ['1 . Appearance Colourless Liquid ', '2 . Density（g/mL,25℃）0913 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）-61 ', '5 . Boiling point（ºC,Atmospheric pressure）73-75 ', '6 . Boiling point（ºC,2mm）Unknow ', '7 . Refractive index（n 20/D ）1418 8 . Flash point（ ºC ） 444 9 . Specific rotation（ º ） Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg,267ºC）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 不能拌and 的or 难以拌and '] |
| Molecular_Structure: | ['1 . Molar refractive index 2785 ', '2 . Molar volume （m3/mol）1062 ', '3 . Parachor （902K）2436 ', '4 . Surface tension 0965 ', '5 . Dielectric constant 无可用 ', '6 偶极距（10 -24cm 3）无可用 ', '7 . Polarizability 1104'] |
| Computational_Chemistry: | ['1. XlogP :15 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :0 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 0 ', '7. Heavy Atom Count :6 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :834 ', '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: | −61 °C(lit.) |
| MF: | C5H7Cl |
| Exact_Mass: | 102.023628 |
| FW: | 102.562 |
| Density: | 1.0±0.1 g/cm3 |
| Symbol: | GHS02, GHS07 |
|---|---|
| RIDADR: | UN 1993 3/PG 2 |
| HS_Code: | 2903299090 |
| Packing_Group: | II |
| Hazard_Class: | 3 |
| Risk_Statements(EU): | R11 |
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard_Codes: | F,Xn,Xi |
| Warning_Statement: | P210-P280 |
| Safety_Statements: | H225-H302 + H312 + H332 |
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