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| CAS No.: | 5398-24-3 |
|---|---|
| Name: | 2-BROMOBUTYRAMIDE |
| Article Data: | 10 |
| Molecular Structure: | |
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| Formula: | C4H8BrNO |
| Molecular Weight: | 166.018 |
| Synonyms: | Butyramide,2-bromo- (6CI,8CI);2-Bromobutanamide;2-Bromobutyramide;NSC 4597; |
| Density: | 1.524 g/cm3 |
| Melting Point: | 112-113 °C |
| Boiling Point: | 250.2 °C at 760 mmHg |
| Flash Point: | 105.1 °C |
| PSA: | 43.09000 |
| LogP: | 1.34550 |
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- Total:19 Page 1 of 1 1
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Specification
The Butanamide, 2-bromo-, with the CAS registry number 5398-24-3, has molecular formula C4H8BrNO. In addition, this chemical's molecular weight is 166.02. Its systematic name is called 2-bromobutanamide.
Physical properties of Butanamide, 2-bromo-: (1)ACD/LogP: 0.36; (2)ACD/LogD (pH 5.5): 0.36; (3)ACD/LogD (pH 7.4): 0.36; (4)ACD/BCF (pH 5.5): 1.1; (5)ACD/BCF (pH 7.4): 1.1; (6)ACD/KOC (pH 5.5): 37.29; (7)ACD/KOC (pH 7.4): 37.29; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.496; (12)Molar Refractivity: 31.83 cm3; (13)Molar Volume: 108.9 cm3; (14)Surface Tension: 40.5 dyne/cm; (15)Density: 1.524 g/cm3; (16)Flash Point: 105.1 °C; (17)Enthalpy of Vaporization: 48.75 kJ/mol; (18)Boiling Point: 250.2 °C at 760 mmHg; (19)Vapour Pressure: 0.022 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: BrC(C(=O)N)CC
(2)InChI: InChI=1/C4H8BrNO/c1-2-3(5)4(6)7/h3H,2H2,1H3,(H2,6,7)
(3)InChIKey: AKSLRYGHJVUELA-UHFFFAOYAT