Cyprodinil

1.Introduction of Cyprodinil

The Cyprodinil, with the CAS registry number 121552-61-2, is also known as 2-Pyrimidinamine,4-cyclopropyl-6-methyl-N-phenyl-. This chemical's molecular formula is C₁₄H₁₅N₃ and molecular weight is 225.29. What's more, its systematic name is 4-Cyclopropyl-6-methyl-N-phenyl-2-pyrimidinamine. Its classification code is Fungicide. This chemical is stable at common pressure and temperature, and its storage temperature is 2 - 8 °C. It is used as agricultural microbicides.

2.Physical properties of Cyprodinil

(1)ACD/LogP: 3.012; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.00; (4)ACD/LogD (pH 7.4): 3.01; (5)ACD/BCF (pH 5.5): 111.29; (6)ACD/BCF (pH 7.4): 114.64; (7)ACD/KOC (pH 5.5): 1006.40; (8)ACD/KOC (pH 7.4): 1036.65; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 37.81 Å²; (13)Index of Refraction: 1.659; (14)Molar Refractivity: 68.661 cm³; (15)Molar Volume: 186.187 cm³; (16)Polarizability: 27.219×10^-24cm³; (17)Surface Tension: 57.5419998168945 dyne/cm ; (18)Density: 1.21 g/cm³; (19)Flash Point: 199.333 °C; (20)Enthalpy of Vaporization: 65.765 kJ/mol; (21)Boiling Point: 405.985 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

3.Structure descriptors of Cyprodinil

(1)SMILES: n1c(cc(nc1Nc2ccccc2)C3CC3)C
(2)Std. InChI: InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)
(3)Std. InChIKey: HAORKNGNJCEJBX-UHFFFAOYSA-N

4.Uses of Cyprodinil

Cyprodinil can be used to produce 4-(4-cyclopropyl-6-methyl-pyrimidin-2-ylamino)-phenol and 4-cyclopropyl-2-(4-hydroxy-phenylamino)-6-methyl-pyrimidin-5-ole. It will need reagent Absidia pseudocylindraspora and solvent ethanol. The yield is about 35.6%.

5.Safety information of Cyprodinil

This chemical is irritating to eyes and skin. It may cause sensitisation by skin contact. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing.