Sodium 2-phenylcinchoninate (5949-18-8),Sodium 2-phenylcinchoninate (5949-18-8) Manufacturers & Suppliers,Synthesis,MSDS

Basic information

Name:
SODIUM-2-PHENYLCINCHONINATE
CAS No.:
5949-18-8
Molecular Structure:
Formula:
C₁₆H₁₁NO₂•Na
Molecular Weight:
272.27
Density:
g/cm³
Boiling Point:
456.9°Cat760mmHg
Flash Point:
230.1°C
Safety Description:
Moderately toxic by ingestion and subcutaneous routes. When heated to decomposition it emits toxic fumes of NO_x and Na₂O. Details

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Chemistry

Molecular Structure of Sodium 2-phenylcinchoninate (CAS NO.5949-18-8):

IUPAC: Sodium 2-phenylquinoline-4-carboxylic acid
Empirical Formula:C₁₆H₁₁NNaO₂
Molecular Weight:272.2533
Flash Point:230.1^oC
Boiling Point:456.9^oC at 760 mmHg
Enthalpy of Vaporization:75.55 kJ/mol
Vapour Pressure:3.84E-09 mmHg at 25^oC
EINECS:227-710-5
H bond acceptors:3
H bond donors:1
SMILES:[Na+].OC(=O)c1cc(nc2ccccc12)c3ccccc3
InChI:InChI=1/C16H11NO2.Na/c18-16(19)13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14;/h1-10H,(H,18,19);/q;+1

Toxicity Data With Reference

1.	scu-mus LDLo:1000 mg/kg	HBAMAK Abdernaldens Handbuch der Biologischen Arbeitsmethoden. 4 (1935),1310.
2.	orl-dog LDLo:3600 mg/kg	HBAMAK Abdernaldens Handbuch der Biologischen Arbeitsmethoden. 4 (1935),1310.
3.	scu-dog LDLo:3600 mg/kg	HBAMAK Abdernaldens Handbuch der Biologischen Arbeitsmethoden. 4 (1935),1310.
4.	orl-cat LDLo:3600 mg/kg	HBAMAK Abdernaldens Handbuch der Biologischen Arbeitsmethoden. 4 (1935),1310.
5.	scu-cat LDLo:3600 mg/kg	HBAMAK Abdernaldens Handbuch der Biologischen Arbeitsmethoden. 4 (1935),1310.
6.	orl-rbt LDLo:1000 mg/kg	HBAMAK Abdernaldens Handbuch der Biologischen Arbeitsmethoden. 4 (1935),1310.
7.	scu-rbt LDLo:500 mg/kg	HBAMAK Abdernaldens Handbuch der Biologischen Arbeitsmethoden. 4 (1935),1310.

Safety Profile

Moderately toxic by ingestion and subcutaneous routes. When heated to decomposition it emits toxic fumes of NO_x and Na₂O.

Specification

Sodium 2-phenylcinchoninate with cas registry number of 5949-18-8 is also known as Cinchophen sodium salt ; Atophan sodium ; Atophan-natrium ; Cinchophen sodium ; Cinchophen, sodium salt ; Sodium 2-phenyl-4-quinolinecarboxylate ; Sodium cinchophen ; 4-Quinolinecarboxylic acid, 2-phenyl-, sodium salt (9CI) ; Cinchoninic acid, 2-phenyl-, sodium salt ; Cinchophen sodium . Sodium 2-phenylcinchoninate with cas registry number of 5949-18-8 is used as an intermediate in synthesis of many valuable compounds.