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Structure

Bis[2-(perfluorooctyl)ethyl] phosphate

CAS
678-41-1
Catalog Number
ACM678411
Category
Main Products
Molecular Weight
990.2
Molecular Formula
C20H9F34O4P

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Specification

Synonyms
3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-Heptadecafluoro-1-decanol-1,1'-(hydrogen phosphate)
Melting Point
102 - 105 °C
Appearance
White to Off-White Solid
What is the molecular formula of bis[2-(perfluorooctyl)ethyl] phosphate?

The molecular formula is (O)P(OH)(OCH2CH2C8F17)2C20H9F34O4P.

What are the synonyms of bis[2-(perfluorooctyl)ethyl] phosphate?

The synonyms are:
Bis(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl) hydrogen phosphate
678-41-1
Bis[2-(perfluorooctyl)ethyl] Phosphate
bisperfluorodecyl phosphate
8:2 Fluorotelomer phosphate diester

What is the molecular weight of bis[2-(perfluorooctyl)ethyl] phosphate?

The molecular weight is 990.2 g/mol.

When was bis[2-(perfluorooctyl)ethyl] phosphate created and modified?

It was created on August 8, 2005, and last modified on October 21, 2023.

What role does bis[2-(perfluorooctyl)ethyl] phosphate have?

It has a role as an environmental contaminant and a xenobiotic.

What is the IUPAC name of bis[2-(perfluorooctyl)ethyl] phosphate?

The IUPAC name is bis(3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodecyl) hydrogen phosphate.

What is the InChI of bis[2-(perfluorooctyl)ethyl] phosphate?

The InChI is: InChI=1S/C20H9F34O4P/c21-5(22,7(25,26)9(29,30)11(33,34)13(37,38)15(41,42)17(45,46)19(49,50)51)1-3-57-59(55,56)58-4-2-6(23,24)8(27,28)10(31,32)12(35,36)14(39,40)16(43,44)18(47,48)20(52,53)54/h1-4H2,(H,55,56).

What is the InChIKey of bis[2-(perfluorooctyl)ethyl] phosphate?

The InChIKey is AFWOYEYXUDHGHF-UHFFFAOYSA-N.

What are the chemical and physical properties of bis[2-(perfluorooctyl)ethyl] phosphate?

The molecular weight is 990.2 g/mol, XLogP3-AA is 11.3, the hydrogen bond donor count is 1, the hydrogen bond acceptor count is 38, the rotatable bond count is 20, the exact mass is 989.9695533 g/mol, the topological polar surface area is 55.8Ų, the heavy atom count is 59, the formal charge is 0, the complexity is 1420, and the covalently-bonded unit count is not specified.

Are there any experimental properties of bis[2-(perfluorooctyl)ethyl] phosphate mentioned in the reference?

No, there are no experimental properties mentioned in the reference.

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