1,1,5,5,5-Hexamethyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-3-[(trimethylsilyl)oxy]trisiloxane

CAS

94237-07-7

Catalog Number

ACM94237077

Category

Other Products

Molecular Weight

642.747482 [g/mol]

Molecular Formula

C₁₇H₃₁F₁₃O₃Si₄

MSDS COA Spec Sheet

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Specification

Synonyms

EINECS 304-106-0, 1,1,5,5,5-Hexamethyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-3-((trimethylsilyl)oxy)trisiloxane, 94237-07-7

IUPAC Name

trimethyl-[3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl-bis(trimethylsilyloxy)silyl]oxysilane

Canonical SMILES

C[Si](C)(C)O[Si](CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(O[Si](C)(C)C)O[Si](C)(C)C

InChI Key

ODHLIRVOARWQJW-UHFFFAOYSA-N

EC Number

304-106-0

Exact Mass

642.11400

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of 1,1,5,5,5-Hexamethyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-3-[(trimethylsilyl)oxy]trisiloxane?

The molecular formula is C17H31F13O3Si4.

What is the molecular weight of 1,1,5,5,5-Hexamethyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-3-[(trimethylsilyl)oxy]trisiloxane?

The molecular weight is 642.7 g/mol.

What is the IUPAC name of 1,1,5,5,5-Hexamethyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-3-[(trimethylsilyl)oxy]trisiloxane?

The IUPAC name is trimethyl-[3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl-bis(trimethylsilyloxy)silyl]oxysilane.

What is the InChI of 1,1,5,5,5-Hexamethyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-3-[(trimethylsilyl)oxy]trisiloxane?

The InChI is InChI=1S/C17H31F13O3Si4/c1-34(2,3)31-37(32-35(4,5)6,33-36(7,8)9)11-10-12(18,19)13(20,21)14(22,23)15(24,25)16(26,27)17(28,29)30/h10-11H2,1-9H3.

What is the InChIKey of 1,1,5,5,5-Hexamethyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-3-[(trimethylsilyl)oxy]trisiloxane?

The InChIKey is ODHLIRVOARWQJW-UHFFFAOYSA-N.

What is the Canonical SMILES of 1,1,5,5,5-Hexamethyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-3-[(trimethylsilyl)oxy]trisiloxane?

The Canonical SMILES is C[Si](C)(C)O[Si](CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(O[Si](C)(C)C)O[Si](C)(C)C.

What is the CAS number of 1,1,5,5,5-Hexamethyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-3-[(trimethylsilyl)oxy]trisiloxane?

The CAS number is 94237-07-7.

How many hydrogen bond acceptor counts are there in 1,1,5,5,5-Hexamethyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-3-[(trimethylsilyl)oxy]trisiloxane?

There are 16 hydrogen bond acceptor counts.

What is the topological polar surface area of 1,1,5,5,5-Hexamethyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-3-[(trimethylsilyl)oxy]trisiloxane?

The topological polar surface area is 27.7?2.

Is 1,1,5,5,5-Hexamethyl-3-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)-3-[(trimethylsilyl)oxy]trisiloxane a canonicalized compound?

Yes, the compound is canonicalized.

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