6-Morpholinonicotinic acid supplier

Name
6-MORPHOLINONICOTINIC ACID
EINECS
CAS No. 120800-52-4
Article Data11
CAS DataBase
Density 1.314 g/cm³
Solubility
Melting Point 258-261°
Formula C₁₀H₁₂N₂O₃
Boiling Point 446.074 °C at 760 mmHg
Molecular Weight 208.217
Flash Point 223.578 °C
Transport Information
Appearance
Safety 26-37/39
Risk Codes Xi:Irritant;
Molecular Structure
Hazard Symbols Xi
Synonyms 6-Morpholin-4-ylnicotinic acid;6-(Morpholin-4-yl)pyridine-3-carboxylicacid;6-(Morpholin-4-yl)nicotinic acid;
PSA 62.66000
LogP 0.68140

6-Morpholinonicotinic acid Specification

The 3-Pyridinecarboxylicacid, 6-(4-morpholinyl)-, with the CAS registry number 120800-52-4, has the systematic name of 6-morpholinopyridine-3-carboxylic acid. It belongs to the following product categories: Acids and Derivatives; Heterocycles; Pharmacetical. And the molecular formula of the chemical is C₁₀H₁₂N₂O₃.

The characteristics of 3-Pyridinecarboxylicacid, 6-(4-morpholinyl)- are as followings: (1)ACD/LogP: 1.05; (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): 2.151; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 5; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 62.66 Å²; (11)Index of Refraction: 1.585; (12)Molar Refractivity: 53.084 cm³; (13)Molar Volume: 158.498 cm³; (14)Polarizability: 21.044×10^-24cm³; (15)Surface Tension: 57.826 dyne/cm; (16)Density: 1.314 g/cm³; (17)Flash Point: 223.578 °C; (18)Enthalpy of Vaporization: 74.211 kJ/mol; (19)Boiling Point: 446.074 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1cc(ncc1C(=O)O)N2CCOCC2
(2)InChI: InChI=1/C10H12N2O3/c13-10(14)8-1-2-9(11-7-8)12-3-5-15-6-4-12/h1-2,7H,3-6H2,(H,13,14)
(3)InChIKey: XXDSDFLDYNISKD-UHFFFAOYAE

Product Name

6-MORPHOLINONICOTINIC ACID

6-Morpholinonicotinic acid Specification

Related Products

Hot Products