3-Bromo-5-methoxybenzoic acid supplier

Name
3-Bromo-5-methoxybenzoic acid
EINECS
CAS No. 157893-14-6
Article Data17
CAS DataBase
Density 1.625 g/cm³
Solubility
Melting Point 190-191 °C(Solv: ethanol (64-17-5))
Formula C₈H₇BrO₃
Boiling Point 338.8 °C at 760 mmHg
Molecular Weight 231.046
Flash Point 158.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Bromo-3-methoxybenzoic acid;
PSA 46.53000
LogP 2.15590

3-Bromo-5-methoxybenzoic acid Specification

The 3-Bromo-5-methoxybenzoic acid, with the CAS registry number 157893-14-6, is also known as 3-Bromo-5-methoxybenzoic acid 99%. It belongs to the product category of Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts. This chemical's molecular formula is C₈H₇BrO₃ and molecular weight is 231.04. Its systematic name is called 3-bromo-5-methoxybenzoic acid.

Physical properties of 3-Bromo-5-methoxybenzoic acid: (1)ACD/LogP: 2.96; (2)ACD/LogD (pH 5.5): 1.16; (3)ACD/LogD (pH 7.4): -0.09; (4)ACD/BCF (pH 5.5): 1.66; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 15.48; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.583; (12)Molar Refractivity: 47.55 cm³; (13)Molar Volume: 142.1 cm³; (14)Surface Tension: 49.2 dyne/cm; (15)Density: 1.625 g/cm³; (16)Flash Point: 158.7 °C; (17)Enthalpy of Vaporization: 61.44 kJ/mol; (18)Boiling Point: 338.8 °C at 760 mmHg; (19)Vapour Pressure: 3.74E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cc(cc(OC)c1)C(=O)O
(2)InChI: InChI=1/C8H7BrO3/c1-12-7-3-5(8(10)11)2-6(9)4-7/h2-4H,1H3,(H,10,11)
(3)InChIKey: DMXJBCHYVUGXEH-UHFFFAOYAT

Product Name

3-Bromo-5-methoxybenzoic acid

3-Bromo-5-methoxybenzoic acid Specification

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