3,4-Pyridinedicarboxylicacid, 5-bromo- supplier

Name
5-Bromopyridine-3,4-dicarboxylic acid
EINECS
CAS No. 90325-36-3
Article Data3
CAS DataBase
Density 1.985 g/cm³
Solubility
Melting Point
Formula C₇H₄BrNO₄
Boiling Point 518.632 °C at 760 mmHg
Molecular Weight 246.017
Flash Point 267.459 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Bromo-3,4-pyridinedicarboxylicacid;
PSA 87.49000
LogP 1.24050

3,4-Pyridinedicarboxylicacid, 5-bromo- Specification

The 3,4-Pyridinedicarboxylicacid, 5-bromo-, with the CAS registry number 90325-36-3, belongs to the product category of Pyridines. This chemical's molecular formula is C₇H₄BrNO₄ and molecular weight is 246.01496. Its systematic name is called 5-bromopyridine-3,4-dicarboxylic acid.

Physical properties of 3,4-Pyridinedicarboxylicacid, 5-bromo-: (1)ACD/LogP: 0.83; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 5; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 2; (9)Index of Refraction: 1.663; (10)Molar Refractivity: 45.894 cm³; (11)Molar Volume: 123.901 cm³; (12)Surface Tension: 84.966 dyne/cm; (13)Density: 1.986 g/cm³; (14)Flash Point: 267.459 °C; (15)Enthalpy of Vaporization: 83.298 kJ/mol; (16)Boiling Point: 518.632 °C at 760 mmHg; (17)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)c1c(cncc1Br)C(O)=O
(2)InChI: InChI=1/C7H4BrNO4/c8-4-2-9-1-3(6(10)11)5(4)7(12)13/h1-2H,(H,10,11)(H,12,13)
(3)InChIKey: ODVOJWAGUGFOCF-UHFFFAOYAQ

Product Name

5-Bromopyridine-3,4-dicarboxylic acid

3,4-Pyridinedicarboxylicacid, 5-bromo- Specification

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