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CAS No.: | 40763-96-0 |
---|---|
Name: | 5-CHLORO-2-NITROBENZAMIDE |
Article Data: | 11 |
Molecular Structure: | |
Formula: | C7H5ClN2O3 |
Molecular Weight: | 200.581 |
Synonyms: | 2-Nitro-5-chlorobenzamide;5-Chloro-2-nitrobenzamide; |
Density: | 1.52 g/cm3 |
Melting Point: | 157-160 °C(lit.) |
Boiling Point: | 301.7 °C at 760 mmHg |
Flash Point: | 136.3 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 26-36 |
PSA: | 88.91000 |
LogP: | 2.57060 |
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The Benzamide,5-chloro-2-nitro- is an organic compound with the formula C7H5ClN2O3. The IUPAC name of this chemical is 5-chloro-2-nitrobenzamide. With the CAS registry number 40763-96-0, it is also named as 5-Chloro-2-nitrobenzamid. The product's categories are Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; Amides; Carbonyl Compounds; Organic Building Blocks. Besides, it should be stored in a closed cool and dry place.
Physical properties about Benzamide,5-chloro-2-nitro- are: (1)ACD/LogP: 1.00; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 3.37; (5)ACD/BCF (pH 7.4): 3.37; (6)ACD/KOC (pH 5.5): 82.97; (7)ACD/KOC (pH 7.4): 82.97; (8)#H bond acceptors: 5; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 66.13 Å2; (12)Index of Refraction: 1.624; (13)Molar Refractivity: 46.62 cm3; (14)Molar Volume: 131.9 cm3; (15)Polarizability: 18.48×10-24cm3; (16)Surface Tension: 63.9 dyne/cm; (17)Density: 1.52 g/cm3; (18)Flash Point: 136.3 °C; (19)Enthalpy of Vaporization: 54.19 kJ/mol; (20)Boiling Point: 301.7 °C at 760 mmHg; (21)Vapour Pressure: 0.00103 mmHg at 25°C.
Uses of Benzamide,5-chloro-2-nitro-: it can be used to produce 2-nitro-5-pyrrolidin-1-yl-benzamide at temperature of 110 °C. It will need solvent dimethylformamide with reaction time of 3 hours.
When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])c1c(cc(Cl)cc1)C(=O)N
(2)InChI: InChI=1/C7H5ClN2O3/c8-4-1-2-6(10(12)13)5(3-4)7(9)11/h1-3H,(H2,9,11)
(3)InChIKey: MKHXTOPPKVFSFI-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C7H5ClN2O3/c8-4-1-2-6(10(12)13)5(3-4)7(9)11/h1-3H,(H2,9,11)
(5)Std. InChIKey: MKHXTOPPKVFSFI-UHFFFAOYSA-N