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CAS No.: | 54321-80-1 |
---|---|
Name: | 3-BROMO-5-NITROBENZAMIDE |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C7H5BrN2O3 |
Molecular Weight: | 245.032 |
Synonyms: | 3-Bromo-5-nitrobenzamide; |
Density: | 1.799 g/cm3 |
Boiling Point: | 311.1 °C at 760 mmHg |
Flash Point: | 141.9 °C |
Hazard Symbols: | Xi |
PSA: | 88.91000 |
LogP: | 2.67970 |
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The Benzamide,3-bromo-5-nitro-, with the CAS registry number 54321-80-1, is also known as 3-Bromo-5-nitrobenzamide. It belongs to the product categories of blocks; Carboxes. This chemical's molecular formula is C7H5BrN2O3 and molecular weight is 245.03. When you are dealing with this chemical, you should be very careful. This chemical is irritating to the skin or other mucous membranes.
Physical properties about Benzamide,3-bromo-5-nitro- are: (1)ACD/LogP: 1.39; (2)#of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 66.13 Å2; (7)Index of Refraction: 1.645; (8)Molar Refractivity: 49.41 cm3; (9)Molar Volume: 136.1 cm3; (10)Surface Tension: 65.7 dyne/cm; (11)Density: 1.799 g/cm3; (12)Flash Point: 141.9 °C; (13)Enthalpy of Vaporization: 55.2 kJ/mol; (14)Boiling Point: 311.1 °C at 760 mmHg; (15)Vapour Pressure: 0.000576 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=[N+]([O-])c1cc(cc(Br)c1)C(=O)N
(2) InChI: InChI=1/C7H5BrN2O3/c8-5-1-4(7(9)11)2-6(3-5)10(12)13/h1-3H,(H2,9,11)
(3) InChIKey: WNYWPPUDAKYNIZ-UHFFFAOYAN