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CAS No.: | 5980-26-7 |
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Name: | 2,3-DICHLOROBENZAMIDE |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C7H5Cl2NO |
Molecular Weight: | 190.029 |
Synonyms: | 2,5-Dichlorobenzamide; |
Density: | 1.439 g/cm3 |
Melting Point: | 170-172 °C |
Boiling Point: | 262.8 °C at 760 mmHg |
Flash Point: | 112.7 °C |
Hazard Symbols: | R36/37/38:; |
Risk Codes: | Xi:; "> Xi:; |
Safety: | 24/25 |
PSA: | 43.09000 |
LogP: | 2.79260 |
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The Benzamide, 2, 5-dichloro-, its CAS registry number is 5980-26-7. It belongs to the product categories of Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; Anilines, Amides & Amines; Chlorine Compounds. This chemical's molecular formula is C7H5Cl2NO and molecular weight is 190.03. What's more, its IUPAC name is 2, 5-Dichlorobenzamide. In addition, it must be stored in airtight containers and placed in a dry, cool place at room temperature. Meanwhile, it should be avoided contact with light. During using it, you should avoid contacting with skin and eyes.
Physical properties about Benzamide, 2, 5-dichloro- are: (1)ACD/LogP: 1.63; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.63; (4)ACD/LogD (pH 7.4): 1.63; (5)ACD/BCF (pH 5.5): 10.16; (6)ACD/BCF (pH 7.4): 10.16; (7)ACD/KOC (pH 5.5): 182.98; (8)ACD/KOC (pH 7.4): 182.98; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.596; (14)Molar Refractivity: 44.97 cm3; (15)Molar Volume: 132 cm3; (16)Surface Tension: 51.3 dyne/cm; (17)Density: 1.439 g/cm3; (18)Flash Point: 112.7 °C; (19)Enthalpy of Vaporization: 50.06 kJ/mol; (20)Boiling Point: 262.8 °C at 760 mmHg; (21)Vapour Pressure: 0.0107 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c1cc(Cl)ccc1Cl)N
(2) InChI: InChI=1/C7H5Cl2NO/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,(H2,10,11)
(3) InChIKey: NMHJIYQWKWHDSX-UHFFFAOYAH