2-AMINO-6-METHYL-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBONITRILE
Catalog No: FT-0611211
CAS No: 42225-04-7
- Molecular Formula: 192.28
- Formula Weight: C10H12N2S
- Inchl Key: VDMBPDMXBJUYMB-LURJTMIESA-N
- Inchl: InChI=1S/C10H12N2S/c1-6-2-3-7-8(5-11)10(12)13-9(7)4-6/h6H,2-4,12H2,1H3/t6-/m0/s1
| 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: | 147 - 149ºC |
|---|---|
| CAS: | 42225-04-7 |
| MF: | C10H12N2S |
| Flash_Point: | 191.4ºC |
| Product_Name: | 2-amino-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile |
| Density: | 1.22 g/cm3 |
| FW: | 192.28100 |
| Bolling_Point: | 392.8ºC at 760 mmHg |
| Refractive_Index: | 1.607 |
|---|---|
| Flash_Point: | 191.4ºC |
| LogP: | 2.90798 |
| Bolling_Point: | 392.8ºC at 760 mmHg |
| FW: | 192.28100 |
| PSA: | 78.05000 |
| Computational_Chemistry: | ['1. XlogP :32 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :2 ', '6. TPSA 78 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :245 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| Melting_Point: | 147 - 149ºC |
| MF: | C10H12N2S |
| Exact_Mass: | 192.07200 |
| Molecular_Structure: | ['1 . Molar refractive index 5415 ', '2 . Molar volume 1568 ', '3 . Parachor （902K）4310 ', '4 . Surface tension 571 ', '5 . Polarizability 2146'] |
| Density: | 1.22 g/cm3 |
| RIDADR: | UN3276 |
|---|---|
| Hazard_Codes: | Xn: Harmful; |
| HS_Code: | 2934999090 |
| Risk_Statements(EU): | R20/21/22 |
| Safety_Statements: | S36/37 |
