2-(1-Adamantyl)-4-methylphenol
Catalog No: FT-0683776
CAS No: 41031-50-9
- Chemical Name: 2-(1-Adamantyl)-4-methylphenol
- Molecular Formula: C17H22O
- Molecular Weight: 242.36
- InChI Key: XHLJIHBDAJFXBE-UHFFFAOYSA-N
- InChI: InChI=1S/C17H22O/c1-11-2-3-16(18)15(4-11)17-8-12-5-13(9-17)7-14(6-12)10-17/h2-4,12-14,18H,5-10H2,1H3
| 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: | Warning |
|---|---|
| FW: | 242.356 |
| Density: | 1.1±0.1 g/cm3 |
| CAS: | 41031-50-9 |
| Bolling_Point: | 359.9±21.0 °C at 760 mmHg |
| Product_Name: | 2-(1-Adamantyl)-4-methylphenol |
| Melting_Point: | 128-130ºC(lit.) |
| Flash_Point: | 169.5±10.6 °C |
| MF: | C17H22O |
| Molecular_Structure: | ['1 . Molar refractive index 7327 ', '2 . Molar volume 2130 ', '3 . Parachor （902K）5669 ', '4 . Surface tension 501 ', '5 . Polarizability 2904 ', '6 . Dielectric constant 未确定'] |
|---|---|
| LogP: | 5.28 |
| Flash_Point: | 169.5±10.6 °C |
| Refractive_Index: | 1.604 |
| FW: | 242.356 |
| Density: | 1.1±0.1 g/cm3 |
| Bolling_Point: | 359.9±21.0 °C at 760 mmHg |
| Computational_Chemistry: | ['1. XlogP :53 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :3 ', '6. TPSA 202 ', '7. Heavy Atom Count :18 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :293 ', '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: | 128-130ºC(lit.) |
| PSA: | 20.23000 |
| MF: | C17H22O |
| Vapor_Pressure: | 0.0±0.8 mmHg at 25°C |
| Exact_Mass: | 242.167068 |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
|---|---|
| Hazard_Codes: | Xi: Irritant; |
| Risk_Statements(EU): | 36/37/38 |
| Safety_Statements: | 26-36 |
| Symbol: | Warning |
| Warning_Statement: | P261-P305 + P351 + P338 |
| RIDADR: | NONH for all modes of transport |
| HS_Code: | 2907199090 |
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