Basic Information | Post buying leads | Suppliers |
Name |
3-Pyridinecarboxylicacid, 2-(4-morpholinyl)- |
EINECS | N/A |
CAS No. | 423768-54-1 | Density | 1.313 g/cm3 |
PSA | 62.66000 | LogP | 0.68140 |
Solubility | N/A | 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 | N/A | Appearance | N/A |
Safety | Risk Codes |
Xi:Irritant; |
|
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
2-(Morpholin-4-yl)nicotinicacid; |
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