6-Bromoquinoline-4-carboxylic acid supplier

Name
6-Bromoquinoline-4-carboxylic acid
EINECS
CAS No. 160233-76-1
Article Data4
CAS DataBase
Density 1.732 g/cm³
Solubility
Melting Point
Formula C₁₀H₆BrNO₂
Boiling Point 403.1 °C at 760 mmHg
Molecular Weight 252.067
Flash Point 197.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-quinolinecarboxylic acid, 6-bromo-; 6-Bromoquinoline-4-carboxylic acid
PSA 50.19000
LogP 2.69550

6-Bromoquinoline-4-carboxylic acid Specification

The 6-Bromoquinoline-4-carboxylic acid is an organic compound with the formula C₁₀H₆BrNO₂. The systematic name of this chemical is 6-bromoquinoline-4-carboxylic acid. With the CAS registry number 160233-76-1, it is also named as 4-quinolinecarboxylic acid, 6-bromo-.

Physical properties about 6-Bromoquinoline-4-carboxylic acid are: (1)ACD/LogP: 2.51; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1.01; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 50.19 Å²; (10)Index of Refraction: 1.709; (11)Molar Refractivity: 56.8 cm³; (12)Molar Volume: 145.4 cm³; (13)Polarizability: 22.51×10^-24cm³; (14)Surface Tension: 68 dyne/cm; (15)Density: 1.732 g/cm³; (16)Flash Point: 197.6 °C; (17)Enthalpy of Vaporization: 69 kJ/mol; (18)Boiling Point: 403.1 °C at 760 mmHg; (19)Vapour Pressure: 3.21E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OC(=O)c1ccnc2ccc(Br)cc12
(2)InChI: InChI=1/C10H6BrNO2/c11-6-1-2-9-8(5-6)7(10(13)14)3-4-12-9/h1-5H,(H,13,14)
(3)InChIKey: QKZZTVSKZXPJAC-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C10H6BrNO2/c11-6-1-2-9-8(5-6)7(10(13)14)3-4-12-9/h1-5H,(H,13,14)
(5)Std. InChIKey: QKZZTVSKZXPJAC-UHFFFAOYSA-N

Product Name

6-Bromoquinoline-4-carboxylic acid

6-Bromoquinoline-4-carboxylic acid Specification

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