3-Bromo-4-chloronitrobenzene supplier

Name
3-BROMO-4-CHLORONITROBENZENE
EINECS
CAS No. 16588-26-4
Article Data8
CAS DataBase
Density 1.827 g/cm³
Solubility
Melting Point 58 °C
Formula C₆H₃BrClNO₂
Boiling Point 287.239 °C at 760 mmHg
Molecular Weight 236.452
Flash Point 127.518 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 20/21/22-36/37/38
Molecular Structure
Hazard Symbols Xi
Synonyms 1-Bromo-2-chloro-5-nitrobenzene;1-Chloro-2-bromo-4-nitrobenzene;2-Bromo-1-chloro-4-nitrobenzene;2-Bromo-4-nitrochlorobenzene;3-Bromo-4-chloro-1-nitrobenzene;3-Bromo-4-chloronitrobenzene;
PSA 45.82000
LogP 3.53390

3-Bromo-4-chloronitrobenzene Specification

This chemical is called Benzene, 2-bromo-1-chloro-4-nitro-, and its systematic name is 2-bromo-1-chloro-4-nitrobenzene. With the molecular formula of C₆H₃BrClNO₂, its molecular weight is 236.45. The CAS registry number of this chemical is 16588-26-4. Additionally, its product category is Miscellaneous.

Other characteristics of the Benzene, 2-bromo-1-chloro-4-nitro- can be summarised as followings: (1)ACD/LogP: 3.09; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.09; (4)ACD/LogD (pH 7.4): 3.09; (5)ACD/BCF (pH 5.5): 130.21; (6)ACD/BCF (pH 7.4): 130.21; (7)ACD/KOC (pH 5.5): 1135.73; (8)ACD/KOC (pH 7.4): 1135.73; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 45.82 Å²; (13)Index of Refraction: 1.618; (14)Molar Refractivity: 45.38 cm³; (15)Molar Volume: 129.4 cm³; (16)Polarizability: 17.99×10^-24cm³; (17)Surface Tension: 52.9 dyne/cm; (18)Density: 1.827 g/cm³; (19)Flash Point: 127.5 °C; (20)Enthalpy of Vaporization: 50.53 kJ/mol; (21)Boiling Point: 287.2 °C at 760 mmHg; (22)Vapour Pressure: 0.00434 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: Clc1ccc([N+]([O-])=O)cc1Br
2.InChI: InChI=1/C6H3BrClNO2/c7-5-3-4(9(10)11)1-2-6(5)8/h1-3H
3.InChIKey: CGTVUAQWGSZCFH-UHFFFAOYAE

Product Name

3-BROMO-4-CHLORONITROBENZENE

3-Bromo-4-chloronitrobenzene Specification

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