Home >> Chemicals Listing >> hot product list by 2  

2-Benzofurancarboxylicacid, 5-bromo-, ethyl ester (84102-69-2)

Identification
Name:2-Benzofurancarboxylicacid, 5-bromo-, ethyl ester
Synonyms:5-Bromobenzofuran-2-carboxylicacid ethyl ester;Ethyl 5-bromobenzo[b]furan-2-carboxylate;Ethyl 5-bromobenzofuran-2-carboxylate;
CAS:84102-69-2
Molecular Formula: C11H9BrO3
Molecular Weight: 269.09
InChI: InChI=1/C11H9BrO3/c1-2-14-11(13)10-6-7-5-8(12)3-4-9(7)15-10/h3-6H,2H2,1H3
Molecular Structure: (C11H9BrO3) 5-Bromobenzofuran-2-carboxylicacid ethyl ester;Ethyl 5-bromobenzo[b]furan-2-carboxylate;Ethyl 5-brom...
Properties
Density:1.52g/cm3
Refractive index:1.599
Specification:

The Ethyl 5-bromobenzofuran-2-carboxylate is an organic compound with the formula C11H9BrO3. The systematic name of this chemical is ethyl 5-bromo-1-benzofuran-2-carboxylate. With the CAS registry number 84102-69-2, it is also named as 2-benzofurancarboxylic acid, 5-bromo-, ethyl ester.

Physical properties about Ethyl 5-bromobenzofuran-2-carboxylate are: (1)ACD/LogP: 3.83; (2)#H bond acceptors: 3; (3)#Freely Rotating Bonds: 3; (4)Polar Surface Area: 39.44 Å2; (5)Index of Refraction: 1.599; (6)Molar Refractivity: 60.49 cm3; (7)Molar Volume: 176.9 cm3; (8)Polarizability: 23.98×10-24cm3; (9)Surface Tension: 45.7 dyne/cm; (10)Density: 1.52 g/cm3; (11)Flash Point: 152.4 °C; (12)Enthalpy of Vaporization: 57.07 kJ/mol; (13)Boiling Point: 328.3 °C at 760 mmHg; (14)Vapour Pressure: 0.000191 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc2cc1c(oc(c1)C(=O)OCC)cc2
(2)InChI: InChI=1/C11H9BrO3/c1-2-14-11(13)10-6-7-5-8(12)3-4-9(7)15-10/h3-6H,2H2,1H3
(3)InChIKey:  XLJWAHXKBCDQNP-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C11H9BrO3/c1-2-14-11(13)10-6-7-5-8(12)3-4-9(7)15-10/h3-6H,2H2,1H3
(5)Std. InChIKey: XLJWAHXKBCDQNP-UHFFFAOYSA-N

Safety Data
Hazard Symbols Xi: Irritant
 

Other Product