3-Pyridinecarboxylicacid, 2-(4-morpholinyl)- supplier

Name
2-MORPHOLINONICOTINIC ACID
EINECS
CAS No. 423768-54-1
Density 1.313 g/cm³
Solubility
Melting Point 130-133 °C
Formula C₁₀H₁₂N₂O₃
Boiling Point 418 °C at 760 mmHg
Molecular Weight 208.217
Flash Point 206.6 °C
Transport Information
Appearance
Safety
Risk Codes Xi:Irritant;
Molecular Structure
Hazard Symbols Xi
Synonyms 2-(Morpholin-4-yl)nicotinicacid;
PSA 62.66000
LogP 0.68140

3-Pyridinecarboxylicacid, 2-(4-morpholinyl)- Specification

The 3-Pyridinecarboxylicacid, 2-(4-morpholinyl)-, with the CAS registry number of 423768-54-1, is also known as 2-(Morpholin-4-yl)nicotinic acid. It belongs to the product categories of Acids and Derivatives; Heterocycles. This chemical's molecular formula is C₁₀H₁₂N₂O₃ and molecular weight is 208.21. What's more, its systematic name is called 2-Morpholin-4-ylpyridine-3-carboxylic acid. Besides, this chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about 3-Pyridinecarboxylicacid, 2-(4-morpholinyl)- are: (1)ACD/LogP: -0.14; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.63; (4)ACD/LogD (pH 7.4): -2.78; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 51.66 Å²; (13)Index of Refraction: 1.584; (14)Molar Refractivity: 53.08 cm³; (15)Molar Volume: 158.4 cm³; (16)Surface Tension: 57.8 dyne/cm; (17)Density: 1.313 g/cm³; (18)Flash Point: 206.6 °C; (19)Enthalpy of Vaporization: 70.8 kJ/mol; (20)Boiling Point: 418 °C at 760 mmHg; (21)Vapour Pressure: 9.78E-08 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(O)c1c(nccc1)N2CCOCC2
(2) InChI: InChI=1/C10H12N2O3/c13-10(14)8-2-1-3-11-9(8)12-4-6-15-7-5-12/h1-3H,4-7H2,(H,13,14)
(3) InChIKey: YDUPMJIUJMCXAL-UHFFFAOYAV

Product Name

2-MORPHOLINONICOTINIC ACID

3-Pyridinecarboxylicacid, 2-(4-morpholinyl)- Specification

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