Pyrimidine,2-chloro-5-propyl- (219555-98-3)

The 2-Chloro-5-propylpyrimidine with the CAS number 219555-98-3 is also called Pyrimidine,2-chloro-5-propyl-. Its molecular formula is C₇H₉ClN₂. This chemical belongs to the following product categories: (1)APIs & Intermediate; (2)Pyrimidine; (3)Pyridines, Pyrimidines, Purines and Pteredines; (4)Halides;Pyrazines, Pyrimidines & Pyridazines.

The properties of the 2-Chloro-5-propylpyrimidine are: (1)ACD/LogP: 1.73; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.728; (4)ACD/LogD (pH 7.4): 1.728; (5)ACD/BCF (pH 5.5): 12.104; (6)ACD/BCF (pH 7.4): 12.104; (7)ACD/KOC (pH 5.5): 207.387; (8)ACD/KOC (pH 7.4): 207.387; (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: 1.517; (14)Molar Refractivity: 41.513 cm³; (15)Molar Volume: 137.156 cm³; (16)Polarizability: 16.457×10^-24cm³; (17)Surface Tension: 41.358 dyne/cm; (18)Enthalpy of Vaporization: 48.122 kJ/mol; (19)Vapour Pressure: 0.017 mmHg at 25°C.

While using this chemical, you should be very cautious. This chemical is not only irritating to skin, but also irritating to eyes and respiratory system. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing, gloves and eye/face protection. Then in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: CCCc1cnc(nc1)Cl
(2)InChI: InChI=1/C7H9ClN2/c1-2-3-6-4-9-7(8)10-5-6/h4-5H,2-3H2,1H3
(3)InChIKey: WVPHBBSAPVBUGZ-UHFFFAOYAY