| Identification | |
| Name: | Benzene,1-(bromomethyl)-2-chloro-3-nitro- |
| Synonyms: | Toluene, a-bromo-2-chloro-3-nitro- (7CI);2-Chloro-3-nitrobenzyl bromide;1-(Bromomethyl)-2-chloro-3-nitrobenzene; |
| CAS: | 89642-16-0 |
| Molecular Formula: | C7H5BrClNO2 |
| Molecular Weight: | 250.48 |
| InChI: | InChI=1/C7H5BrClNO2/c8-4-5-2-1-3-6(7(5)9)10(11)12/h1-3H,4H2 |
| Molecular Structure: |  |
| Properties | |
| Density: | 1.755 g/cm3 |
| Refractive index: | 1.623 |
| Specification: |
The 1-(Bromomethyl)-2-chloro-3-nitrobenzene with the CAS number 89642-16-0 is also called Benzene,1-(bromomethyl)-2-chloro-3-nitro-. Its molecular formula is C7H5BrClNO2. This chemical is a kind of organics. It should be stored in dry and cool environment. The properties of the chemical are: (1)ACD/LogP: 3.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.04; (4)ACD/LogD (pH 7.4): 3.04; (5)ACD/BCF (pH 5.5): 119.52; (6)ACD/BCF (pH 7.4): 119.52; (7)ACD/KOC (pH 5.5): 1068.17; (8)ACD/KOC (pH 7.4): 1068.17; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 45.82 Å2; (13)Index of Refraction: 1.623; (14)Molar Refractivity: 50.34 cm3; (15)Molar Volume: 142.7 cm3; (16)Polarizability: 19.95×10-24cm3; (17)Surface Tension: 54.3 dyne/cm; (18)Enthalpy of Vaporization: 55.2 kJ/mol; (19)Vapour Pressure: 0.000289 mmHg at 25°C. You can still convert the following datas into molecular structure: |
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