Benzoic acid,5-bromo-4-chloro-2-hydroxy- supplier

Name
5-Bromo-4-chlorosalicylic acid
EINECS
CAS No. 142167-38-2
Article Data6
CAS DataBase
Density 1.956 g/cm³
Solubility
Melting Point
Formula C₇H₄BrClO₃
Boiling Point 370.8 °C at 760 mmHg
Molecular Weight 251.464
Flash Point 178 °C
Transport Information
Appearance
Safety
Risk Codes Xi:;
Molecular Structure
Hazard Symbols Xi
Synonyms 5-Bromo-4-chlorosalicylic acid;5-Bromo-4-chloro-2-hydroxybenzoic acid;
PSA 57.53000
LogP 2.50630

Benzoic acid,5-bromo-4-chloro-2-hydroxy- Specification

The Benzoic acid,5-bromo-4-chloro-2-hydroxy-, with the CAS registry number 142167-38-2, is also known as 5-Bromo-4-chlorosalicylic acid. This chemical's molecular formula is C₇H₄BrClO₃ and molecular weight is 251.46. What's more, its systematic name is 5-Bromo-4-chloro-2-hydroxybenzoic acid and it belongs to the product categories of Blocks; Bromides; Carboxes.

Physical properties of Benzoic acid,5-bromo-4-chloro-2-hydroxy- are: (1)ACD/LogP: 4.10; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.98; (4)ACD/LogD (pH 7.4): 0.95; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 3.09; (8)ACD/KOC (pH 7.4): 2.87; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.663; (14)Molar Refractivity: 47.64 cm³; (15)Molar Volume: 128.5 cm³; (16)Polarizability: 18.88×10^-24cm³; (17)Surface Tension: 69.2 dyne/cm; (18)Density: 1.956 g/cm³; (19)Flash Point: 178 °C; (20)Enthalpy of Vaporization: 65.17 kJ/mol; (21)Boiling Point: 370.8 °C at 760 mmHg; (22)Vapour Pressure: 3.74E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Oc1cc(Cl)c(Br)cc1C(O)=O
(2)InChI: InChI=1/C7H4BrClO3/c8-4-1-3(7(11)12)6(10)2-5(4)9/h1-2,10H,(H,11,12)
(3)InChIKey: XUKLAPBPFXGIOW-UHFFFAOYSA-N

Product Name

5-Bromo-4-chlorosalicylic acid

Benzoic acid,5-bromo-4-chloro-2-hydroxy- Specification

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