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Structure

7-Isopropyl-5-methylbicyclo[2.2.2]oct-5-ene-2-carbaldehyde

CAS
93904-56-4
Catalog Number
ACM93904564
Category
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What is the molecular formula of the compound with PubChem CID 44149601?

The molecular formula is C13H20O.

What is the molecular weight of the compound with PubChem CID 44149601?

The molecular weight is 192.30 g/mol.

What is the IUPAC name of the compound with PubChem CID 44149601?

The IUPAC name is 5-methyl-7-propan-2-ylbicyclo[2.2.2]oct-5-ene-2-carbaldehyde.

What is the InChIKey of the compound with PubChem CID 44149601?

The InChIKey is LKERFQHZNFIXLI-UHFFFAOYSA-N.

How many hydrogen bond acceptors does the compound with PubChem CID 44149601 have?

It has 1 hydrogen bond acceptor.

What is the topological polar surface area of the compound with PubChem CID 44149601?

The topological polar surface area is 17.1 Å2.

How many rotatable bonds does the compound with PubChem CID 44149601 have?

It has 2 rotatable bonds.

Is the compound with PubChem CID 44149601 canonicalized?

Yes, the compound is canonicalized.

What is the XLogP3-AA value of the compound with PubChem CID 44149601?

The XLogP3-AA value is 2.6.

What is the CAS number of the compound with PubChem CID 44149601?

The CAS number is 93904-56-4.

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