Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
Pyridine, 2-(chloromethyl)-4-(trifluoromethyl)- |
EINECS | N/A |
CAS No. | 215867-87-1 | Density | 1.359 g/cm3 |
PSA | 12.89000 | LogP | 2.83920 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H5ClF3N | Boiling Point | 199.6 °C at 760 mmHg |
Molecular Weight | 195.57 | Flash Point | 74.5 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
2-(CHLOROMETHYL)-4-(TRIFLUOROMETHYL)PYRIDINE;PYRIDINE, 2-(CHLOROMETHYL)-4-(TRIFLUOROMETHYL)- |
Article Data | 2 |
The Pyridine, 2-(chloromethyl)-4-(trifluoromethyl)- has CAS registry number 215867-87-1. This chemical's molecular formula is C7H5ClF3N and molecular weight is 195.57. What's more, its systematic name is 2-(chloromethyl)-4-(trifluoromethyl)pyridine.
Physical properties of Pyridine, 2-(chloromethyl)-4-(trifluoromethyl)- are: (1)ACD/LogP: 1.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.57; (4)ACD/LogD (pH 7.4): 1.57; (5)ACD/BCF (pH 5.5): 9.13; (6)ACD/BCF (pH 7.4): 9.13; (7)ACD/KOC (pH 5.5): 169.47; (8)ACD/KOC (pH 7.4): 169.49; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 12.89 Å2; (13)Index of Refraction: 1.455; (14)Molar Refractivity: 39.08 cm3; (15)Molar Volume: 143.8 cm3; (16)Polarizability: 15.49×10-24cm3; (17)Surface Tension: 29 dyne/cm; (18)Density: 1.359 g/cm3; (19)Flash Point: 74.5 °C; (20)Enthalpy of Vaporization: 41.79 kJ/mol; (21)Boiling Point: 199.6 °C at 760 mmHg; (22)Vapour Pressure: 0.48 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: ClCc1cc(ccn1)C(F)(F)F
(2)Std. InChI: InChI=1S/C7H5ClF3N/c8-4-6-3-5(1-2-12-6)7(9,10)11/h1-3H,4H2
(3)Std. InChIKey: KAGAMWQQBRRVBH-UHFFFAOYSA-N