2-Bromo-4,5-difluorobenzoic acid supplier

Name
2-BROMO-4,5-DIFLUOROBENZOIC ACID
EINECS
CAS No. 64695-84-7
Article Data4
CAS DataBase
Density 1.872 g/cm³
Solubility
Melting Point 118-122 °C(lit.)
Formula C₇H₃BrF₂O₂
Boiling Point 291.3 °C at 760 mmHg
Molecular Weight 237
Flash Point 130 °C
Transport Information
Appearance White to yellow crystalline powder
Safety 36
Risk Codes 22
Molecular Structure
Hazard Symbols Xn,Xi
Synonyms 2-Bromo-4,5-difluorobenzoicacid;
PSA 37.30000
LogP 2.42550

2-Bromo-4,5-difluorobenzoic acid Specification

The Benzoic acid,2-bromo-4,5-difluoro-, with the CAS registry number 64695-84-7, is also known as Benzoic acid, 2-bromo-4,5-difluoro-. It belongs to the product categories of Benzoic acid; C7; Carbonyl Compounds; Carboxylic Acids. This chemical's molecular formula is C₇H₃BrF₂O₂ and molecular weight is 237.00. Its systematic name is called 2-bromo-4,5-difluorobenzoic acid. This chemical is white to yellow crystalline powder.

Physical properties of Benzoic acid,2-bromo-4,5-difluoro-: (1)ACD/LogP: 2.43; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.37; (4)ACD/LogD (pH 7.4): -0.72; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (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: 1.558; (13)Molar Refractivity: 40.86 cm³; (14)Molar Volume: 126.5 cm³; (15)Surface Tension: 48.5 dyne/cm; (16)Density: 1.872 g/cm³; (17)Flash Point: 130 °C; (18)Enthalpy of Vaporization: 56.05 kJ/mol; (19)Boiling Point: 291.3 °C at 760 mmHg; (20)Vapour Pressure: 0.000902 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health and may cause inflammation to the skin or other mucous membranes. It is harmful if swallowed. In addition, it is irritating to eyes.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1cc(F)c(F)cc1Br
(2)InChI: InChI=1/C7H3BrF2O2/c8-4-2-6(10)5(9)1-3(4)7(11)12/h1-2H,(H,11,12)
(3)InChIKey: DGCBGBZYTNTZJH-UHFFFAOYAB

Product Name

2-BROMO-4,5-DIFLUOROBENZOIC ACID

2-Bromo-4,5-difluorobenzoic acid Specification

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