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85118-38-3

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Basic Information
CAS No.: 85118-38-3
Name: 1-[2-(2-chloroethoxy)ethyl]pyridinium chloride
Molecular Structure:
Molecular Structure of 85118-38-3 (1-[2-(2-chloroethoxy)ethyl]pyridinium chloride)
Formula: C9H13Cl2NO
Molecular Weight: 222.11
Synonyms: Pyridinium,1-[2-(2-chloroethoxy)ethyl]-, chloride (9CI);1-[2-(2-Chloroethoxy)ethyl]pyridinium chloride;1-[2-(2-Chloroethoxy)ethyl]pyridin-1-ium chloride;
EINECS: 285-692-4
PSA: 13.11000
LogP: -1.76650
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  • Pyridinium,1-[2-(2-chloroethoxy)ethyl]-, chloride (1:1)

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    85118-38-3

    Pyridinium,1-[2-(2-chloroethoxy)ethyl]-, chloride (1:1)

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  • Pyridinium,1-[2-(2-chloroethoxy)ethyl]-, chloride (1:1)

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    85118-38-3

    Pyridinium,1-[2-(2-chloroethoxy)ethyl]-, chloride (1:1)

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Specification

The Pyridinium,1-[2-(2-chloroethoxy)ethyl]-, chloride (1:1), with the CAS registry number 85118-38-3, is also known as 1-[2-(2-Chloroethoxy)ethyl]pyridinium chloride. Its EINECS number is 285-692-4. This chemical's molecular formula is C9H13Cl2NO and molecular weight is 222.11. What's more, its systematic name is 1-[2-(2-chloroethoxy)ethyl]pyridin-1-ium chloride.

Physical properties of Pyridinium,1-[2-(2-chloroethoxy)ethyl]-, chloride (1:1) are: (1)#H bond acceptors: 2; (2)#H bond donors: 0; (3)#Freely Rotating Bonds: 5; (4)Polar Surface Area: 13.11 Å2.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=[N+](C=C1)CCOCCCl.[Cl-]
(2)InChI: InChI=1S/C9H13ClNO.ClH/c10-4-8-12-9-7-11-5-2-1-3-6-11;/h1-3,5-6H,4,7-9H2;1H/q+1;/p-1
(3)InChIKey: PTMSYUSEEYPPMU-UHFFFAOYSA-M