Butanedioic acid,2-(4-bromophenyl)- supplier

Name
(4-BROMOPHENYL)SUCCINIC ACID
EINECS
CAS No. 71471-40-4
Article Data4
CAS DataBase
Density 1.691 g/cm³
Solubility
Melting Point
Formula C₁₀H₉BrO₄
Boiling Point 375.4 °C at 760 mmHg
Molecular Weight 273.083
Flash Point 180.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Butanedioicacid, (4-bromophenyl)- (9CI);Succinic acid, (p-bromophenyl)- (6CI);(p-Bromophenyl)succinic acid;
PSA 74.60000
LogP 2.09200

Butanedioic acid,2-(4-bromophenyl)- Specification

The Butanedioic acid,2-(4-bromophenyl)-, with the CAS registry number 71471-40-4, is also known as (4-Bromophenyl)succinic acid and 2-(4-Bromophenyl)succinic acid. This chemical's molecular formula is C₁₀H₉BrO₄ and molecular weight is 273.08. What's more, its systematic name is 2-(4-Bromophenyl)butanedioic acid. In addition, this chemical may cause inflammation to the skin or other mucous membranes

Physical properties about Butanedioic acid,2-(4-bromophenyl)- are: (1)ACD/LogP: 1.99; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 74.6 Å²; (11)Index of Refraction: 1.608; (12)Molar Refractivity: 55.88 cm³; (13)Molar Volume: 161.4 cm³; (14)Polarizability: 22.15×10^-24 cm³; (15)Surface Tension: 63.7 dyne/cm; (16)Density: 1.691 g/cm³; (17)Flash Point: 180.8 °C; (18)Enthalpy of Vaporization: 65.71 kJ/mol; (19)Boiling Point: 375.4 °C at 760 mmHg; (20)Vapour Pressure: 2.65E-06 mmHg at 25 °C.

Preparation of Butanedioic acid,2-(4-bromophenyl)-: this chemical can be prepared by Chloroacetic acid and (4-Bromo-phenyl)-acetonitrile. This reaction needs reagents K₂CO₃, KOH and solvent Dimethylformamide at temperature of 20-25 °C. The reaction time is 2 hours. The yield is 84.6 %.

Butanedioic acid,2-(4-bromophenyl)- can be prepared by Chloroacetic acid and (4-Bromo-phenyl)-acetonitrile

You can still convert the following datas into molecular structure:
(1) SMILES: Brc1ccc(cc1)C(CC(O)=O)C(O)=O
(2) InChI: InChI=1/C10H9BrO4/c11-7-3-1-6(2-4-7)8(10(14)15)5-9(12)13/h1-4,8H,5H2,(H,12,13)(H,14,15)
(3) InChIKey: OVOOMMVRUQGTIQ-UHFFFAOYAT

Product Name

(4-BROMOPHENYL)SUCCINIC ACID

Butanedioic acid,2-(4-bromophenyl)- Specification

Related Products

Hot Products