2-BROMODECANOIC ACID

This chemical is called Decanoic acid, 2-bromo-, and its systematic name is 2-bromodecanoic acid. With the molecular formula of C₁₀H₁₉BrO₂, its molecular weight is 251.16. The CAS registry number of this chemical is 2623-95-2.

Other characteristics of the Decanoic acid, 2-bromo- can be summarised as followings: (1)ACD/LogP: 4.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.08; (4)ACD/LogD (pH 7.4): 0.91; (5)ACD/BCF (pH 5.5): 5.59; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 23.25; (8)ACD/KOC (pH 7.4): 1.58; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 26.3 Å²; (13)Index of Refraction: 1.483; (14)Molar Refractivity: 57.63 cm³; (15)Molar Volume: 201.7 cm³; (16)Polarizability: 22.84×10^-24cm³; (17)Surface Tension: 38 dyne/cm; (18)Density: 1.244 g/cm³; (19)Flash Point: 143.5 °C; (20)Enthalpy of Vaporization: 61.01 kJ/mol; (21)Boiling Point: 313.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000106 mmHg at 25°C.

Uses of this chemical: The 2-amino-decanoic acid could be obtained by the reactant of Decanoic acid, 2-bromo-. This reaction needs the reagent of liquid NH_3. This reaction should be taken at the temperature of 50 °C.

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

You can still convert the following datas into molecular structure:
1.SMILES: BrC(C(=O)O)CCCCCCCC
2.InChI: InChI=1/C10H19BrO2/c1-2-3-4-5-6-7-8-9(11)10(12)13/h9H,2-8H2,1H3,(H,12,13)
3.InChIKey: KNLOTZNPRIFUAR-UHFFFAOYAI