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36839-55-1

Basic Information
CAS No.: 36839-55-1
Name: 1,2-BIS(2-IODOETHOXY)ETHANE
Article Data: 13
Molecular Structure:
Molecular Structure of 36839-55-1 (1,2-BIS(2-IODOETHOXY)ETHANE)
Formula: C6H12I2O2
Molecular Weight: 369.969
Synonyms: 1,2-Bis(2-iodoethoxy)ethane;
Density: 2.079 g/cm3
Boiling Point: 293.5 °C at 760 mmHg
Flash Point: 131.3 °C
Appearance: clear red-orange liquid
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-37/39
PSA: 18.46000
LogP: 1.88960
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Specification

The Ethane,1,2-bis(2-iodoethoxy)-, with the CAS registry number of 36839-55-1, is also known as 1,2-Bis(2-iodoethoxy)ethane. It belongs to the product categories of Ethers; Organic Building Blocks; Oxygen Compounds. This chemical's molecular formula is C6H12I2O2 and molecular weight is 369.97. What's more, its systematic name is 1-Iodo-2-[2-(2-iodoethoxy)ethoxy]ethane. In addition, it must be stored in airtight containers and placed in a dry, cool place. Besides, you should ensure the work place is well-ventilated.

Physical properties about the Ethane,1,2-bis(2-iodoethoxy)- are: (1)ACD/LogP: 2.21; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.21; (4)ACD/LogD (pH 7.4): 2.21; (5)ACD/BCF (pH 5.5): 28.33; (6)ACD/BCF (pH 7.4): 28.33; (7)ACD/KOC (pH 5.5): 381.22; (8)ACD/KOC (pH 7.4): 381.22; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.58; (14)Molar Refractivity: 59.27 cm3; (15)Molar Volume: 177.9 cm3; (16)Surface Tension: 43.9 dyne/cm; (17)Density: 2.079 g/cm3; (18)Flash Point: 131.3 °C; (19)Enthalpy of Vaporization: 51.18 kJ/mol; (20)Boiling Point: 293.5 °C at 760 mmHg; (21)Vapour Pressure: 0.00301 mmHg at 25 °C.

Uses: it is used to produce other chemicals. For example, it is used to produce 1,10-Difurfuryl-4,7-dioxa-1,10-diazadecane. The reaction time is 24 h with reaction temperature of 100 °C. The yield is about 94 %.

The Ethane,1,2-bis(2-iodoethoxy)- can react with Furfurylamine to get 1,10-Difurfuryl-4,7-dioxa-1,10-diazadecane

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. In addition, during using it, wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1) SMILES: ICCOCCOCCI
(2) InChI: InChI=1/C6H12I2O2/c7-1-3-9-5-6-10-4-2-8/h1-6H2
(3) InChIKey: BCAGFJXMCZSAHD-UHFFFAOYAI