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Structure

8-Methyl-1-oxaspiro[5.5]undecan-2-one

CAS
94201-05-5
Catalog Number
ACM94201055
Category
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What is the molecular formula of 8-Methyl-1-oxaspiro[5.5]undecan-2-one?

The molecular formula is C11H18O2.

When was the PubChem CID 44147308 created and last modified?

It was created on 2009-08-20 and last modified on 2023-12-30.

What is the IUPAC Name of the compound?

The IUPAC Name is 10-methyl-1-oxaspiro[5.5]undecan-2-one.

What is the Canonical SMILES of the compound?

The Canonical SMILES is CC1CCCC2(C1)CCCC(=O)O2.

What is the molecular weight of 8-Methyl-1-oxaspiro[5.5]undecan-2-one?

The molecular weight is 182.26 g/mol.

What is the InChIKey of the compound?

The InChIKey is ARHBNCKQGPMGQO-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts are present in the compound?

There are 2 hydrogen bond acceptor counts.

What is the XLogP3-AA value of 8-Methyl-1-oxaspiro[5.5]undecan-2-one?

The XLogP3-AA value is 2.6.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the topological polar surface area of 8-Methyl-1-oxaspiro[5.5]undecan-2-one?

The topological polar surface area is 26.3 Ų.

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