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Structure

1,4-Cyclohexanedione bis(ethylene ketal)

CAS
183-97-1
Catalog Number
ACM183971
Category
Ortho Esters
Molecular Weight
200.23
Molecular Formula
C10H13BrO2

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Specification

Hazard Statements
H226-H315-H319-H335
RIDADR
NONH for all modes of transport
Symbol
GHS02
What is the molecular formula of 1,4-Cyclohexanedione bis(ethylene ketal)?

The molecular formula of 1,4-Cyclohexanedione bis(ethylene ketal) is C10H16O4.

What is the molecular weight of 1,4-Cyclohexanedione bis(ethylene ketal)?

The molecular weight of 1,4-Cyclohexanedione bis(ethylene ketal) is 200.23 g/mol.

What is the IUPAC name of 1,4-Cyclohexanedione bis(ethylene ketal)?

The IUPAC name of 1,4-Cyclohexanedione bis(ethylene ketal) is 1,4,9,12-tetraoxadispiro[4.2.4 8 .2 5 ]tetradecane.

What is the InChI of 1,4-Cyclohexanedione bis(ethylene ketal)?

The InChI of 1,4-Cyclohexanedione bis(ethylene ketal) is InChI=1S/C10H16O4/c1-2-10(13-7-8-14-10)4-3-9(1)11-5-6-12-9/h1-8H2.

What is the InChIKey of 1,4-Cyclohexanedione bis(ethylene ketal)?

The InChIKey of 1,4-Cyclohexanedione bis(ethylene ketal) is YSMVSEYPOBXSOK-UHFFFAOYSA-N.

What is the Canonical SMILES of 1,4-Cyclohexanedione bis(ethylene ketal)?

The Canonical SMILES of 1,4-Cyclohexanedione bis(ethylene ketal) is C1CC2(CCC13OCCO3)OCCO2.

What is the XLogP3-AA value of 1,4-Cyclohexanedione bis(ethylene ketal)?

The XLogP3-AA value of 1,4-Cyclohexanedione bis(ethylene ketal) is 0.3.

How many hydrogen bond acceptor counts does 1,4-Cyclohexanedione bis(ethylene ketal) have?

1,4-Cyclohexanedione bis(ethylene ketal) has 4 hydrogen bond acceptor counts.

What is the topological polar surface area of 1,4-Cyclohexanedione bis(ethylene ketal)?

The topological polar surface area of 1,4-Cyclohexanedione bis(ethylene ketal) is 36.9Ų.

Is 1,4-Cyclohexanedione bis(ethylene ketal) a canonicalized compound?

Yes, 1,4-Cyclohexanedione bis(ethylene ketal) is a canonicalized compound.

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