Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Methyl-4-iodo-3-hydroxy benzoate |
EINECS | N/A |
CAS No. | 157942-12-6 | Density | 1.881 g/cm3 |
PSA | 46.53000 | LogP | 1.78340 |
Solubility | Slightly soluble in water. | Melting Point |
53-54 °C |
Formula | C8H7IO3 | Boiling Point | 299.288 °C at 760 mmHg |
Molecular Weight | 278.046 | Flash Point | 134.805 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
3-Hydroxy-4-iodobenzoicacid methyl ester;Methyl 3-hydroxy-4-iodobenzoate; |
Article Data | 35 |
The Benzoic acid,3-hydroxy-4-iodo-, methyl ester is an organic compound with the formula C8H7IO3. The IUPAC name of this chemical is Methyl 3-hydroxy-4-iodobenzoate. With the CAS registry number 157942-12-6, it is also named as 3-Hydroxy-4-iodobenzoic acid methyl ester. Besides, its molecular weight is 278.04.
Physical properties about Benzoic acid,3-hydroxy-4-iodo-, methyl ester are: (1)ACD/LogP: 3.23; (2)ACD/LogD (pH 5.5): 3.22; (3)ACD/LogD (pH 7.4): 3.05; (4)ACD/BCF (pH 5.5): 165.89; (5)ACD/BCF (pH 7.4): 111.12; (6)ACD/KOC (pH 5.5): 1348.25; (7)ACD/KOC (pH 7.4): 903.13; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 35.53 Å2; (12)Index of Refraction: 1.633; (13)Molar Refractivity: 52.81 cm3; (14)Molar Volume: 147.8 cm3; (15)Polarizability: 20.93×10-24 cm3; (16)Surface Tension: 55 dyne/cm; (17)Density: 1.88 g/cm3; (18)Flash Point: 134.8 °C; (19)Enthalpy of Vaporization: 56.08 kJ/mol; (20)Boiling Point: 299.3 °C at 760 mmHg; (21)Vapour Pressure: 0.000677 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C8H7IO3/c1-12-8(11)5-2-3-6(9)7(10)4-5/h2-4,10H,1H3
(2)InChIKey: LXCQVWRESZDFGW-UHFFFAOYAY
(3)Std. InChI: InChI=1S/C8H7IO3/c1-12-8(11)5-2-3-6(9)7(10)4-5/h2-4,10H,1H3
(4)Std. InChIKey: LXCQVWRESZDFGW-UHFFFAOYSA-N