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CAS No.: | 56035-64-4 |
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Name: | 2,4-Dichloro-6-methyl-5-Pyrimidinecarbonitrile |
Molecular Structure: | |
Formula: | C6H3Cl2N3 |
Molecular Weight: | 188.0141 |
Synonyms: | NSC521707; |
Density: | 1.51 g/cm3 |
Boiling Point: | 318.7 °C at 760 mmHg |
Flash Point: | 146.6 °C |
PSA: | 49.57000 |
LogP: | 1.96348 |
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The 2,4-Dichloro-6-methyl-pyrimidine-5-carbonitrile, with the CAS registry number 56035-64-4, is also known as NSC521707. This chemical's molecular formula is C6H3Cl2N3 and molecular weight is 188.017. Its IUPAC name is called 2,4-dichloro-6-methylpyrimidine-5-carbonitrile.
Physical properties of 2,4-Dichloro-6-methyl-pyrimidine-5-carbonitrile: (1)ACD/LogP: 1.02; (2)#H bond acceptors: 3; (3)#H bond donors: 0; (4)#Freely Rotating Bonds: 0; (5)Index of Refraction: 1.577; (6)Molar Refractivity: 41.19 cm3; (7)Molar Volume: 124.3 cm3; (8)Surface Tension: 67.7 dyne/cm; (9)Density: 1.51 g/cm3; (10)Flash Point: 146.6 °C; (11)Enthalpy of Vaporization: 56.03 kJ/mol; (12)Boiling Point: 318.7 °C at 760 mmHg; (13)Vapour Pressure: 0.000354 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=C(C(=NC(=N1)Cl)Cl)C#N
(2)InChI: InChI=1S/C6H3Cl2N3/c1-3-4(2-9)5(7)11-6(8)10-3/h1H3
(3)InChIKey: YQBPLKJZELWYDH-UHFFFAOYSA-N