1-Ethyl-2-iodo-3-methylbenzene supplier

Name
2-ETHYL-6-METHYLIODOBENZENE
EINECS
CAS No. 175277-95-9
Article Data2
CAS DataBase
Density 1.532 g/cm³
Solubility
Melting Point 28°C (estimate)
Formula C₉H₁₁I
Boiling Point 245 °C at 760 mmHg
Molecular Weight 246.091
Flash Point 107.1 °C
Transport Information
Appearance clear yellow to red-brown liquid
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms BUTTPARK 88\11-40;1-ETHYL-2-IODO-3-METHYLBENZENE;2-ETHYL-6-METHYLIODOBENZENE;3-Ethyl-2-iodotoluene;2-Ethyl-6-methyliodobenzene,98%
PSA 0.00000
LogP 3.16200

1-Ethyl-2-iodo-3-methylbenzene Specification

This chemical is called 1-Ethyl-2-iodo-3-methylbenzene, and it can also be named as Benzene, 1-ethyl-2-iodo-3-methyl-. With the molecular formula of C₉H₁₁I, its molecular weight is 246.09. The CAS registry number of this chemical is 175277-95-9. Please avoid contacting with skin and eyes if you use it. Keep this chemical sealed in the cool and dry place, away from oxides.

Other characteristics of the 1-Ethyl-2-iodo-3-methylbenzene can be summarised as followings: (1)ACD/LogP: 4.70; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.7; (4)ACD/LogD (pH 7.4): 4.7; (5)ACD/BCF (pH 5.5): 2203.65; (6)ACD/BCF (pH 7.4): 2203.65; (7)ACD/KOC (pH 5.5): 8602.36; (8)ACD/KOC (pH 7.4): 8602.36; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.581; (13)Molar Refractivity: 53.53 cm³; (14)Molar Volume: 160.5 cm³; (15)Polarizability: 21.22×10^-24cm³; (16)Surface Tension: 37.3 dyne/cm; (17)Density: 1.532 g/cm³; (18)Flash Point: 107.1 °C; (19)Enthalpy of Vaporization: 46.25 kJ/mol; (20)Boiling Point: 245 °C at 760 mmHg; (21)Vapour Pressure: 0.0462 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Ic1c(cccc1CC)C
2.InChI: InChI=1/C9H11I/c1-3-8-6-4-5-7(2)9(8)10/h4-6H,3H2,1-2H3
3.InChIKey: PCSPENCTMKMGFE-UHFFFAOYAG

Product Name

2-ETHYL-6-METHYLIODOBENZENE

1-Ethyl-2-iodo-3-methylbenzene Specification

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