2-(Bromomethyl)-1-chloro-4-nitrobenzene supplier

Name
2-(Bromomethyl)-1-chloro-4-nitrobenzene
EINECS
CAS No. 52427-01-7
Article Data10
CAS DataBase
Density 1.755 g/cm³
Solubility
Melting Point 85-87°C
Formula C₇H₅BrClNO₂
Boiling Point 329 °C at 760 mmHg
Molecular Weight 250.479
Flash Point 152.8 °C
Transport Information
Appearance
Safety 26-36/37/39
Risk Codes 36/37/38
Molecular Structure
Hazard Symbols
Synonyms 2-(BROMOMETHYL)-1-CHLORO-4-NITROBENZENE;2-Chloro-5-nitrobenzylbromide;Benzene, 2-(broMoMethyl)-1-chloro-4-nitro-
PSA 45.82000
LogP 3.66630

2-(Bromomethyl)-1-chloro-4-nitrobenzene Specification

This chemical is called 2-(Bromomethyl)-1-chloro-4-nitrobenzene. With the molecular formula of C₇H₅BrClNO₂, its molecular weight is 250.48. The CAS registry number of this chemical is 52427-01-7.

Other characteristics of the 2-(Bromomethyl)-1-chloro-4-nitrobenzene can be summarised as followings: (1)ACD/LogP: 3.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.3; (4)ACD/LogD (pH 7.4): 3.3; (5)ACD/BCF (pH 5.5): 189.77; (6)ACD/BCF (pH 7.4): 189.77; (7)ACD/KOC (pH 5.5): 1487.16; (8)ACD/KOC (pH 7.4): 1487.16; (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)Density: 1.755 g/cm³; (19)Flash Point: 152.8 °C; (20)Enthalpy of Vaporization: 54.88 kJ/mol; (21)Boiling Point: 329 °C at 760 mmHg; (22)Vapour Pressure: 0.000349 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: BrCc1cc(ccc1Cl)[N+]([O-])=O
2.InChI: InChI=1/C7H5BrClNO2/c8-4-5-3-6(10(11)12)1-2-7(5)9/h1-3H,4H2
3.InChIKey: OGWGXOGPGAAWPM-UHFFFAOYAI

Product Name

2-(Bromomethyl)-1-chloro-4-nitrobenzene

2-(Bromomethyl)-1-chloro-4-nitrobenzene Specification

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