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Name |
Benzenamine, 2-bromo-5-chloro-4-methyl- |
EINECS | N/A |
CAS No. | 102170-52-5 | Density | 1.619 g/cm3 |
PSA | 26.02000 | LogP | 3.57430 |
Solubility | N/A | Melting Point |
90 °C |
Formula | C7H7BrClN | Boiling Point | 281.3 °C at 760 mmHg |
Molecular Weight | 220.496 | Flash Point | 123.9 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes |
Xi:; |
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Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
4-Amino-5-bromo-2-chlorotoluene; |
Article Data | 4 |
The Benzenamine, 2-bromo-5-chloro-4-methyl-, with the CAS registry number 102170-52-5, is also known as 4-Amino-5-bromo-2-chlorotoluene. It belongs to the product categories of Amines; Blocks; Bromides. This chemical's molecular formula is C7H7BrClN and molecular weight is 220.49. What's more, its systematic name is 2-Bromo-5-chloro-4-methylaniline. When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties about Benzenamine, 2-bromo-5-chloro-4-methyl- are: (1)ACD/LogP: 3.47; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.47; (4)ACD/LogD (pH 7.4): 3.47; (5)ACD/BCF (pH 5.5): 255.36; (6)ACD/BCF (pH 7.4): 255.43; (7)ACD/KOC (pH 5.5): 1839.15; (8)ACD/KOC (pH 7.4): 1839.62; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.621; (14)Molar Refractivity: 47.89 cm3; (15)Molar Volume: 136.1 cm3; (16)Polarizability: 18.98×10-24 cm3; (17)Surface Tension: 47.3 dyne/cm; (18)Density: 1.619 g/cm3; (19)Flash Point: 123.9 °C; (20)Enthalpy of Vaporization: 52.01 kJ/mol; (21)Boiling Point: 281.3 °C at 760 mmHg; (22)Vapour Pressure: 0.0036 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1c(cc(Br)c(N)c1)C
(2)InChI: InChI=1/C7H7BrClN/c1-4-2-5(8)7(10)3-6(4)9/h2-3H,10H2,1H3
(3)InChIKey: ULCBEYQOSOVMMA-UHFFFAOYAG