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CAS No.: | 7043-09-6 |
---|---|
Name: | 4,6-Dichloro-2-cyclopropylpyrimidine |
Article Data: | 5 |
Molecular Structure: | |
Formula: | C7H6Cl2N2 |
Molecular Weight: | 189.0419 |
Synonyms: | 4,6-Dichloro-2-cyclopropyl-pyrimidine; |
Density: | 1.479 g/cm3 |
Melting Point: | 105-107 °C |
Boiling Point: | 268.5 °C at 760 mmHg |
Flash Point: | 142.1 °C |
PSA: | 25.78000 |
LogP: | 2.66080 |
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The 4, 6-Dichloro-2-cyclopropylpyrimidine has CAS registry number 7043-09-6. This chemical's molecular formula is C7H6Cl2N2 and molecular weight is 189.0419. What's more, its systematic name is 4, 6-Dichloro-2-cyclopropyl-pyrimidine.
Physical properties about 4, 6-Dichloro-2-cyclopropylpyrimidine are: (1)ACD/LogP: 1.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.52; (4)ACD/LogD (pH 7.4): 1.52; (5)#H bond acceptors: 2; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 25.78 Å2; (9)Index of Refraction: 1.609; (10)Molar Refractivity: 44.25 cm3; (11)Molar Volume: 127.7 cm3; (12)Polarizability: 17.54×10-24 cm3; (13)Surface Tension: 58.6 dyne/cm; (14)Density: 1.479 g/cm3; (15)Flash Point: 142.1 °C; (16)Enthalpy of Vaporization: 48.61 kJ/mol; (17)Boiling Point: 268.5 °C at 760 mmHg; (18)Vapour Pressure: 0.0127 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Clc1cc(Cl)nc(n1)C2CC2
(2) InChI: InChI=1/C7H6Cl2N2/c8-5-3-6(9)11-7(10-5)4-1-2-4/h3-4H,1-2H2
(3) InChIKey: YBOWZANEONZCOL-UHFFFAOYAP