Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
4,6-dichloro-2,5-diphenylpyrimidine |
EINECS | N/A |
CAS No. | 29133-99-1 | Density | 1.307 g/cm3 |
PSA | 25.78000 | LogP | 5.11740 |
Solubility | N/A | Melting Point |
130-133 °C(lit.) |
Formula | C16H10Cl2N2 | Boiling Point | 326.9 °C at 760 mmHg |
Molecular Weight | 301.175 | Flash Point | 181.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
4,6-Dichloro-2,5-diphenylpyrimidine;4,6-Dichloro-2,5-diphenylpyrimidine; |
Article Data | 3 |
The 4,6-dichloro-2,5-diphenylpyrimidine with the CAS registry number 29133-99-1 belongs to the classes of Building Blocks; Halogenated Heterocycles; Heterocyclic Building Blocks; Pyrimidines; Pyrimidines Heterocyclic Building Blocks. The IUPAC name is 4,6-dichloro-2,5-diphenylpyrimidine. In addition, the molecular formula is C16H10Cl2N2 and the molecular weight is 301.17. And it should be stored in cool and dry place.
Physical properties about 4,6-dichloro-2,5-diphenylpyrimidine: (1)ACD/LogP: 5.54; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.54; (4)ACD/LogD (pH 7.4): 5.54; (5)ACD/BCF (pH 5.5): 9588.56; (6)ACD/BCF (pH 7.4): 9588.56; (7)ACD/KOC (pH 5.5): 24645; (8)ACD/KOC (pH 7.4): 24645; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 25.78 Å2; (13)Index of Refraction: 1.624; (14)Molar Refractivity: 81.4 cm3; (15)Molar Volume: 230.3 cm3; (16)Polarizability: 32.27 ×10-24cm3; (17)Surface Tension: 50.4 dyne/cm; (18)Density: 1.307 g/cm3; (19)Flash Point: 181.4 °C; (20)Enthalpy of Vaporization: 54.65 kJ/mol; (21)Boiling Point: 326.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000399 mmHg at 25°C.
Uses of 2,4-Dimethylimidazole: it can react with Quinine to get C56H56N6O4. This reaction will need reagent KOH and solvent toluene. The reaction time is 12 hours for refluxing and the yield is about 80%.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you contact it, please wear suitable protective clothing.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1nc(nc(Cl)c1c2ccccc2)c3ccccc3
(2)InChI: InChI=1/C16H10Cl2N2/c17-14-13(11-7-3-1-4-8-11)15(18)20-16(19-14)12-9-5-2-6-10-12/h1-10H
(3)InChIKey: SYZDNTMHIDTVBR-UHFFFAOYAZ