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CAS No.: | 42020-21-3 |
---|---|
Name: | 2,5-DIMETHOXYBENZAMIDE |
Article Data: | 12 |
Molecular Structure: | |
Formula: | C9H11NO3 |
Molecular Weight: | 181.191 |
Synonyms: | 2,5-Dimethoxybenzamide;NSC 269901; |
Density: | 1.16 g/cm3 |
Boiling Point: | 295.9 °C at 760 mmHg |
Flash Point: | 142.5 °C |
PSA: | 61.55000 |
LogP: | 1.50300 |
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The Benzamide,2,5-dimethoxy-, with the CAS registry number 42020-21-3, is also known as NSC269901. It belongs to the product category of Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts. This chemical's molecular formula is C9H11NO3 and molecular weight is 181.073893. Its IUPAC name is called 2,5-dimethoxybenzamide.
Physical properties of Benzamide,2,5-dimethoxy-: (1)ACD/LogP: 1.03; (2)ACD/LogD (pH 5.5): 1.03; (3)ACD/LogD (pH 7.4): 1.03; (4)ACD/BCF (pH 5.5): 3.57; (5)ACD/BCF (pH 7.4): 3.57; (6)ACD/KOC (pH 5.5): 86.5; (7)ACD/KOC (pH 7.4): 86.5; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Index of Refraction: 1.534; (12)Molar Refractivity: 48.54 cm3; (13)Molar Volume: 156.1 cm3; (14)Surface Tension: 40.9 dyne/cm; (15)Density: 1.16 g/cm3; (16)Flash Point: 142.5 °C; (17)Enthalpy of Vaporization: 53.56 kJ/mol; (18)Boiling Point: 295.9 °C at 760 mmHg; (19)Vapour Pressure: 0.00148 mmHg at 25°C.
Preparation: this chemical can be prepared by 2.5-Dimethoxy-benzoesaeure-methylester. This reaction will need reagent aq. NH3.
Uses of Benzamide,2,5-dimethoxy-: it can be used to produce 2,5-dimethoxy-6-nitrobenzamide. This reaction will need reagent HNO3.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: COC1=CC(=C(C=C1)OC)C(=O)N
(2)InChI: InChI=1S/C9H11NO3/c1-12-6-3-4-8(13-2)7(5-6)9(10)11/h3-5H,1-2H3,(H2,10,11)
(3)InChIKey: KLYZILOJVQMYSK-UHFFFAOYSA-N