4-Bromo-2,5-dichlorobenzoic Acid supplier

Name
4-Bromo-2,5-dichlorobenzoic Acid
EINECS
CAS No. 885532-41-2
Density 1.9g/cm³
Solubility
Melting Point
Formula C₇H₃BrCl₂O₂
Boiling Point 347.574 °C at 760 mmHg
Molecular Weight 269.91
Flash Point 164.007 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Bromo-2,5-dichlorobenzoic acid;benzoic acid, 4-bromo-2,5-dichloro-
PSA 37.30000
LogP 3.45410

4-Bromo-2,5-dichlorobenzoic Acid Specification

The 4-Bromo-2,5-dichlorobenzoic Acid, with CAS registry number 885532-41-2, has the systematic name of 4-bromo-2,5-dichlorobenzoic acid. Besides this, it is also called benzoic acid, 4-bromo-2,5-dichloro-. And the chemical formula of this chemical is C₇H₃BrCl₂O₂.

Physical properties of 4-Bromo-2,5-dichlorobenzoic Acid: (1)ACD/LogP: 4.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 4; (8)ACD/KOC (pH 7.4): 2; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 37.3 Å²; (13)Index of Refraction: 1.632; (14)Molar Refractivity: 50.663 cm³; (15)Molar Volume: 142.049 cm³; (16)Polarizability: 20.084×10^-24cm³; (17)Surface Tension: 57.779 dyne/cm; (18)Density: 1.9 g/cm³; (19)Flash Point: 164.007 °C; (20)Enthalpy of Vaporization: 62.461 kJ/mol; (21)Boiling Point: 347.574 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(C(O)=O)c(Cl)cc1Br
(2)InChI: InChI=1/C7H3BrCl2O2/c8-4-2-5(9)3(7(11)12)1-6(4)10/h1-2H,(H,11,12)
(3)InChIKey: DVJHKDHDHAPDPH-UHFFFAOYAD
(4)Std. InChI: InChI=1S/C7H3BrCl2O2/c8-4-2-5(9)3(7(11)12)1-6(4)10/h1-2H,(H,11,12)
(5)Std. InChIKey: DVJHKDHDHAPDPH-UHFFFAOYSA-N

Product Name

4-Bromo-2,5-dichlorobenzoic Acid

4-Bromo-2,5-dichlorobenzoic Acid Specification

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