Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
1,2-Ethanediol,1,2-di-4-pyridinyl- |
EINECS | 230-120-0 |
CAS No. | 6950-04-5 | Density | 1.303 g/cm3 |
PSA | 66.24000 | LogP | 1.24360 |
Solubility | N/A | Melting Point |
215-217 °C |
Formula | C12H12N2O2 | Boiling Point | 451.1 °C at 760 mmHg |
Molecular Weight | 216.239 | Flash Point | 226.6 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1,2-Bis(4-pyridyl)ethane-1,2-diol;NSC 26025;a,b-Di(4-pyridyl)glycol;1,2-Bis(4-pyridyl) glycol;1,2-Ethanediol,1,2-di-4-pyridyl- (6CI,7CI,8CI); |
Article Data | 4 |
The 1,2-Ethanediol,1,2-di-4-pyridinyl-, with the CAS registry number 6950-04-5, is also known as 1,2-Bis(4-pyridinyl)ethane-1,2-diol. Its EINECS registry number is 230-120-0. This chemical's molecular formula is C12H12N2O2 and molecular weight is 216.24. What's more, its IUPAC name is 1,2-Dipyridin-4-ylethane-1,2-diol and systematic name is 1,2-Di(4-pyridyl)ethanediol.
Physical properties about 1,2-Ethanediol,1,2-di-4-pyridinyl- are: (1)ACD/LogP: -1.13; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.62; (4)ACD/LogD (pH 7.4): -1.13; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.88; (8)ACD/KOC (pH 7.4): 5.7; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 44.24 Å2; (13)Index of Refraction: 1.636; (14)Molar Refractivity: 59.54 cm3; (15)Molar Volume: 165.9 cm3; (16)Polarizability: 23.6×10-24cm3; (17)Surface Tension: 67.2 dyne/cm; (18)Density: 1.303 g/cm3; (19)Flash Point: 226.6 °C; (20)Enthalpy of Vaporization: 74.83 kJ/mol; (21)Boiling Point: 451.1 °C at 760 mmHg; (22)Vapour Pressure: 6.3E-09 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: OC(c1ccncc1)C(O)c2ccncc2
(2) InChI: InChI=1/C12H12N2O2/c15-11(9-1-5-13-6-2-9)12(16)10-3-7-14-8-4-10/h1-8,11-12,15-16H
(3) InChIKey: DHKSJSQSVHHBPH-UHFFFAOYAO