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| CAS No.: | 289039-25-4 |
|---|---|
| Name: | 3-CHLORO-5-IODOBENZOIC ACID |
| Article Data: | 2 |
| Molecular Structure: | |
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|
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| Formula: | C7H4ClIO2 |
| Molecular Weight: | 282.465 |
| Synonyms: | 5-Chloro-3-iodobenzoic acid; |
| Density: | 2.077 g/cm3 |
| Melting Point: | 190-191℃ |
| Boiling Point: | 360.5 °C at 760 mmHg |
| Flash Point: | 171.8 °C |
| Hazard Symbols: |
 Xi
|
| PSA: | 37.30000 |
| LogP: | 2.64280 |
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Specification
The Benzoicacid, 3-chloro-5-iodo-, with the CAS registry number 289039-25-4, is also known as 5-Chloro-3-iodobenzoic acid. It belongs to the product categories of Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts; Benzoic acid; Acids & Esters; Chlorine Compounds; Iodine Compounds. This chemical's molecular formula is C7H4ClIO2 and molecular weight is 282.46. Its systematic name is called 3-chloro-5-iodo-benzoic acid. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties of Benzoicacid, 3-chloro-5-iodo-: (1)ACD/LogP: 3.66; (2)ACD/LogD (pH 5.5): 1.67; (3)ACD/LogD (pH 7.4): 0.58 ; (4)#H bond acceptors: 2; (5)#H bond donors: 1; (6)#Freely Rotating Bonds: 1; (7)Index of Refraction: 1.673; (8)Molar Refractivity: 50.98 cm3; (9)Molar Volume: 135.9 cm3; (10)Surface Tension: 61.5 dyne/cm; (11)Density: 2.077 g/cm3; (12)Flash Point: 171.8 °C; (13)Enthalpy of Vaporization: 63.97 kJ/mol; (14)Boiling Point: 360.5 °C at 760 mmHg; (15)Vapour Pressure: 7.94E-06 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Ic1cc(cc(Cl)c1)C(O)=O
(2)InChI: InChI=1/C7H4ClIO2/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H,10,11)
(3)InChIKey: LFLGQMGSWYRAMO-UHFFFAOYAT