

1-ADAMANTANEACETONITRILE
Catalog No: FT-0608364
CAS No: 16269-13-9
- Molecular Formula: 175.27
- Formula Weight: C12H17N
- Inchl Key: DXQVPXCZIRQITG-UHFFFAOYSA-N
- Inchl: InChI=1S/C12H17N/c13-2-1-12-6-9-3-10(7-12)5-11(4-9)8-12/h9-11H,1,3-8H2
Assay | Pack | Price | Stock | Action |
---|---|---|---|---|
98% | 1g | N/A | N/A | |
98% | 5g | N/A | N/A | |
98% | Bulk Quantity | N/A | N/A |
Melting_Point: | 70 |
---|---|
CAS: | 16269-13-9 |
MF: | C12H17N |
Flash_Point: | 137.4±3.8 °C |
Product_Name: | 1-Adamantaneacetonitrile |
Density: | 1.1±0.1 g/cm3 |
FW: | 175.270 |
Bolling_Point: | 295.0±9.0 °C at 760 mmHg |
Refractive_Index: | 1.534 |
---|---|
Vapor_Pressure: | 0.0±0.6 mmHg at 25°C |
Flash_Point: | 137.4±3.8 °C |
LogP: | 2.97 |
Bolling_Point: | 295.0±9.0 °C at 760 mmHg |
PSA: | 23.79000 |
Molecular_Structure: | ['1 . Molar refractive index 5136 ', '2 . Molar volume (m3/mol)1651 ', '3 . Parachor (902K)4333 ', '4 . Surface tension 473 ', '5 . Polarizability 2036'] |
Computational_Chemistry: | ['1. XlogP :34 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :N/A ', '6. TPSA 238 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :229 ', '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: | 70 |
MF: | C12H17N |
Exact_Mass: | 175.136093 |
FW: | 175.270 |
Density: | 1.1±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) 70 5 . Boiling point(ºC,Atmospheric pressure) Unknow ', '6. Boiling point(ºC,52kPa)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,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'] |
Hazard_Class: | 6.1 |
---|---|
Risk_Statements(EU): | R20/21/22 |
RIDADR: | 3276 |
Safety_Statements: | S22-S36/37 |
HS_Code: | 2926909090 |
Packing_Group: | III |
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