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CAS No.: | 1780-33-2 |
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Name: | 4,6-Dichloro-2,5-Dimethyl Pyrimidine |
Molecular Structure: | |
Formula: | C6H6Cl2N2 |
Molecular Weight: | 177.033 |
Synonyms: | 2,5-Dimethyl-4,6-dichloropyrimidine;NSC 40212; |
Density: | 1.338 g/cm3 |
Boiling Point: | 232.311 °C at 760 mmHg |
Flash Point: | 116.632 °C |
PSA: | 25.78000 |
LogP: | 2.40020 |
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The CAS register number of 4,6-Dichloro-2,5-dimethylpyrimidine is 1780-33-2. It also can be called as Pyrimidine,4,6-dichloro-2,5-dimethyl- and the IUPAC name about this chemical is 4,6-dichloro-2,5-dimethylpyrimidine.
Physical properties about 4,6-Dichloro-2,5-dimethylpyrimidine are: (1)ACD/LogP: 2.04; (2)ACD/LogD (pH 5.5): 2.041; (3)ACD/LogD (pH 7.4): 2.041; (4)ACD/BCF (pH 5.5): 20.934; (5)ACD/BCF (pH 7.4): 20.934; (6)ACD/KOC (pH 5.5): 306.962; (7)ACD/KOC (pH 7.4): 306.962; (8)#H bond acceptors: 2; (9)Polar Surface Area: 25.78Å2; (10)Index of Refraction: 1.546; (11)Molar Refractivity: 41.875 cm3; (12)Molar Volume: 132.333 cm3; (13)Polarizability: 16.601x10-24cm3; (14)Surface Tension: 44.922 dyne/cm; (15)Enthalpy of Vaporization: 44.995 kJ/mol; (16)Boiling Point: 232.311 °C at 760 mmHg; (17)Vapour Pressure: 0.09 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1c(nc(nc1Cl)C)Cl
(2)InChI: InChI=1/C6H6Cl2N2/c1-3-5(7)9-4(2)10-6(3)8/h1-2H3
(3)InChIKey: BXVKGWQEEXPBAW-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C6H6Cl2N2/c1-3-5(7)9-4(2)10-6(3)8/h1-2H3
(5)Std. InChIKey: BXVKGWQEEXPBAW-UHFFFAOYSA-N