2-Amino-4-iodobenzoic acid supplier

Name
2-Amino-4-iodobenzoic acid
EINECS
CAS No. 20776-54-9
Article Data9
CAS DataBase
Density 2.082 g/cm³
Solubility
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
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-AMINO-4-IODOBENZOIC ACID
PSA 63.32000
LogP 2.15280

2-Amino-4-iodobenzoic acid Specification

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

Product Name

2-Amino-4-iodobenzoic acid

2-Amino-4-iodobenzoic acid Specification

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