Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
2-Amino-4-iodobenzoic acid |
EINECS | N/A |
CAS No. | 20776-54-9 | Density | 2.082 g/cm3 |
PSA | 63.32000 | LogP | 2.15280 |
Solubility | N/A | Melting Point |
208 °C (decomp)(Solv: ethanol (64-17-5)) |
Formula | C7H6INO2 | Boiling Point | 377.02 °C at 760 mmHg |
Molecular Weight | 263.035 | Flash Point | 181.815 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-AMINO-4-IODOBENZOIC ACID |
Article Data | 9 |
This chemical is called 2-Amino-4-iodobenzoic acid, and it can also be named as Benzoic acid, 2-amino-4-iodo-. With the molecular formula of C7H6INO2, its molecular weight is 263.03. The CAS registry number of this chemical is 20776-54-9.
Other characteristics of the 2-Amino-4-iodobenzoic acid can be summarised as followings: (1)ACD/LogP: 2.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 10; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 82; (8)ACD/KOC (pH 7.4): 2; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 63.32 Å2; (13)Index of Refraction: 1.728; (14)Molar Refractivity: 50.326 cm3; (15)Molar Volume: 126.316 cm3; (16)Polarizability: 19.951×10-24cm3; (17)Surface Tension: 74.29 dyne/cm; (18)Density: 2.082 g/cm3; (19)Flash Point: 181.815 °C; (20)Enthalpy of Vaporization: 65.903 kJ/mol; (21)Boiling Point: 377.02 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)c1ccc(I)cc1N
2.InChI: InChI=1/C7H6INO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,9H2,(H,10,11)
3.InChIKey: KWIIUIVETQQQHX-UHFFFAOYAN