99% up Dapagliflozi...

99% up Dapagliflozin Intermediate/ Empagliflozin Intermediate/ 5-Bromo-2-Chlorobenzoic Acid 21739-92-4
99% up Dapagliflozin Intermediate/ Empagliflozin Intermediate/ 5-Bromo-2-Chlorobenzoic Acid 21739-92-4
99% up Dapagliflozin Intermediate/ Empagliflozin Intermediate/ 5-Bromo-2-Chlorobenzoic Acid 21739-92-4
99% up Dapagliflozin Intermediate/ Empagliflozin Intermediate/ 5-Bromo-2-Chlorobenzoic Acid 21739-92-4
99% up Dapagliflozin Intermediate/ Empagliflozin Intermediate/ 5-Bromo-2-Chlorobenzoic Acid 21739-92-4

99% up Dapagliflozin Intermediate/ Empagliflozin Intermediate/ 5-Bromo-2-Chlorobenzoic Acid 21739-92-4

Min.Order / FOB Price:Get Latest Price

2 Kilogram

FOB Price:USD 55.0000 -200.0000

  • Min.Order :2 Kilogram
  • Purity: 99% up
  • Payment Terms : L/C,D/A,D/P,T/T,

Keywords

Empagliflozin Intermediate Dapagliflozin Intermediate Dapagliflozin

Quick Details

  • Appearance:White powder
  • Application:Agrochemical Intermediates, Flavor & Fragrance Intermediates, Synt
  • PackAge:1kg/bag ;5kg/drum:25KG/drum
  • ProductionCapacity:20|Metric Ton|Month
  • Storage:in low tempreture
  • Transportation:in low tempreture

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Details:

Product Information

Product name

5-Bromo-2-chlorobenzoic acid

Synonyms

5-bromo-2-chloro-benzoate;5-bromo-2-chloro-benzoic acid;2-Chloro-5-bromobenzoic acid;5-Bromo-2-Chloro Benzoic Acid;2-Chloro-5-Bromo Benzoic Acid;

CAS No.

21739-92-4

Molecular Formula

C7H4BrClO2

Molecular Weight

235.465

Molecular Structure

Quality Standard

99% up by HPLC

Appearance

White to off-white powder

 

 

 

 

The characteristics of 5-Bromo-2-chlorobenzoic acid can be summarized as: 

(1)ACD/LogP: 2.79;

(2)# of Rule of 5 Violations: 0;

(3)ACD/LogD (pH 5.5): 0.02;

(4)ACD/LogD (pH 7.4): -0.35;

(5)ACD/BCF (pH 5.5): 1;

(6)ACD/BCF (pH 7.4): 1;

(7)ACD/KOC (pH 5.5): 1.32;

(8)ACD/KOC (pH 7.4): 1;

(9)#H bond acceptors: 2;

(10)#H bond donors: 1;

(11)#Freely Rotating Bonds: 1;

(12)Index of Refraction: 1.621;

(13)Molar Refractivity: 45.76 cm3;

(14)Molar Volume: 130 cm3;

(15)Polarizability: 18.14×10-24 cm3;

(16)Surface Tension: 55.9 dyne/cm;

(17)Enthalpy of Vaporization: 59.81 kJ/mol;

(18)Vapour Pressure: 0.0001 mmHg at 25°C;

(19)Rotatable Bond Count: 1;

(20)Exact Mass: 233.90832;

(21)MonoIsotopic Mass: 233.90832;

(22)Topological Polar Surface Area: 37.3;

(23)Heavy Atom Count: 11;

(24)Complexity: 163.

 

Preparation of 5-Bromo-2-chlorobenzoic acid: It can be obtained by 1-bromo-4-chloro-benzene and carbon dioxide. This reaction needs reagent 2,2,6,6-tetramethylpiperidine, butyllithium and solvent tetrahydrofuran and hexane at temperature of -75 °C. The reaction time is 2 hours. The yield is 52%.

 

Uses of 5-Bromo-2-chlorobenzoic acid: It can be used to produce 2-chloro-5-deuteriobenzoic acid. This reaction needs reagent sodium carbonate, Raney Cu-Al alloy and solvent D2O at temperature of 65 °C. The reaction time is 8 hours. The yield is 88%. 

 

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