1,2,3,4-Tetrahydro-benzo[b]azepin-5-one
Catalog No: FT-0600780
CAS No: 1127-74-8
- Molecular Formula: 161.2
- Formula Weight: C10H11NO
- Inchl Key: NKRKBYFBKLDCFB-UHFFFAOYSA-N
- Inchl: InChI=1S/C10H11NO/c12-10-6-3-7-11-9-5-2-1-4-8(9)10/h1-2,4-5,11H,3,6-7H2
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: | 87-88°C |
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CAS: | 1127-74-8 |
MF: | C10H11NO |
Flash_Point: | 142.8±19.7 °C |
Product_Name: | 1,2,3,4-Tetrahydrobenzo[b]azepin-5-one |
Density: | 1.1±0.1 g/cm3 |
FW: | 161.200 |
Bolling_Point: | 314.6±12.0 °C at 760 mmHg |
Refractive_Index: | 1.548 |
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Vapor_Pressure: | 0.0±0.7 mmHg at 25°C |
Flash_Point: | 142.8±19.7 °C |
LogP: | 2.82 |
Bolling_Point: | 314.6±12.0 °C at 760 mmHg |
FW: | 161.200 |
PSA: | 29.10000 |
Computational_Chemistry: | ['1. XlogP :17 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :2 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :9 ', '6. TPSA 291 ', '7. Heavy Atom Count :12 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :179 ', '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: | 87-88°C |
MF: | C10H11NO |
Exact_Mass: | 161.084061 |
Molecular_Structure: | ['1 . Molar refractive index 4651 ', '2 . Molar volume 1465 ', '3 . Parachor (902K)3660 ', '4 . Surface tension 389 ', '5 . Polarizability 1844'] |
Density: | 1.1±0.1 g/cm3 |
More_Info: | ['1. Density(g/cm3)11 ', '2. Boiling point(760 mmHg,ºC)3146 ', '3. Flash point(ºC)1428'] |
Risk_Statements(EU): | R36/37/38:Irritating to eyes, respiratory system and skin . |
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WGK_Germany: | 3 |
RTECS: | ZE3900000 |
Hazard_Codes: | Xi |
HS_Code: | 2933990090 |
Safety_Statements: | S26-S36 |