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Structure

7,8,12-Trioxaspiro[5.6]dodecane,9-[1-(1-naphthalenyl)ethenyl]-

CAS
917100-89-1
Catalog Number
ACM917100891
Category
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What is the molecular formula of 7,8,12-Trioxaspiro[5.6]dodecane,9-[1-(1-naphthalenyl)ethenyl] according to the reference?

The molecular formula is C21H24O3.

What is the molecular weight of 7,8,12-Trioxaspiro[5.6]dodecane,9-[1-(1-naphthalenyl)ethenyl] as computed by PubChem?

The molecular weight is 324.4 g/mol.

When was the molecule created according to the reference?

The molecule was created on February 5, 2007.

What is the IUPAC name of 7,8,12-Trioxaspiro[5.6]dodecane,9-[1-(1-naphthalenyl)ethenyl] as computed by Lexichem TK?

The IUPAC name is 9-(1-naphthalen-1-ylethenyl)-7,8,12-trioxaspiro[5.6]dodecane.

What is the InChI key of 7,8,12-Trioxaspiro[5.6]dodecane,9-[1-(1-naphthalenyl)ethenyl] as computed by PubChem?

The InChI key is KDVODVUCBGJVIO-UHFFFAOYSA-N.

How many hydrogen bond acceptor counts does the molecule have as computed by Cactvs?

The molecule has 3 hydrogen bond acceptor counts.

What is the exact mass of 7,8,12-Trioxaspiro[5.6]dodecane,9-[1-(1-naphthalenyl)ethenyl] as computed by PubChem?

The exact mass is 324.17254462 g/mol.

Does the molecule have any defined atom stereocenter counts?

No, the molecule does not have any defined atom stereocenter counts.

What is the topological polar surface area of the molecule as computed by Cactvs?

The topological polar surface area is 27.7 Ų.

Is the compound canonicalized according to PubChem?

Yes, the compound is canonicalized.

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