The the CAS registry number Heptanoic acid,7-bromo-,ethyl ester is 29823-18-5. The EINECS registry number is 249-883-6. The IUPAC name is ethyl 7-bromoheptanoate. It belongs to the classes of Pharmaceutical Intermediates; C8 to C9; Carbonyl Compounds; Esters. In addition, the molecular formula is C₉H₁₇BrO₂ and the molecular weight is 237.1341. It has irritant.

Physical properties about this chemical are: (1)ACD/LogP: 3.23; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.23; (4)ACD/LogD (pH 7.4): 3.23; (5)ACD/BCF (pH 5.5): 166.73; (6)ACD/BCF (pH 7.4): 166.73; (7)ACD/KOC (pH 5.5): 1355.59; (8)ACD/KOC (pH 7.4): 1355.59; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.461; (14)Molar Refractivity: 53.25 cm³; (15)Molar Volume: 193.7 cm³; (16)Polarizability: 21.11×10^-24cm³; (17)Surface Tension: 33.7 dyne/cm; (18)Density: 1.223 g/cm³; (19)Flash Point: 129 °C; (20)Enthalpy of Vaporization: 48.57 kJ/mol; (21)Boiling Point: 248.5 °C at 760 mmHg; (22)Vapour Pressure: 0.0241 mmHg at 25°C.

Uses of Heptanoic acid,7-bromo-, ethyl ester: It can react with succinimide to get 7-(2,5-Dioxo-1-pyrrolidinyl)heptansaeure-ethylester. This reaction will need reagent NaH and solvent dimethylformamide. The reaction time is 24 hours with temperature of 20°C and the yield is about 56%.

When you are using this chemical, please be cautious about it as the following:
It irritates to eyes, respiratory system and skin. Therefore, you should wear suitable protective clothing. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: BrCCCCCCC(=O)OCC
(2)InChI: InChI=1/C9H17BrO2/c1-2-12-9(11)7-5-3-4-6-8-10/h2-8H2,1H3
(3)InChIKey: OOBFNDGMAGSNKA-UHFFFAOYAA