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(10E,12E,14E)-Hexadecatrienal

CAS
123363-47-3
Catalog Number
ACM123363473
Category
Insect Pheromone
Molecular Weight
222.37
Molecular Formula
C15H26O

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What is the molecular formula of the compound represented by the given PubChem CID?

The molecular formula is C16H26O.

What is the molecular weight of the compound?

The molecular weight is 234.38 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is hexadeca-10,12,14-trienal.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C16H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-7,16H,8-15H2,1H3.

What is the InChIKey of the compound?

The InChIKey of the compound is QXMRYABYXKUWCX-UHFFFAOYSA-N.

What is the canonical SMILES representation of the compound?

The canonical SMILES representation is CC=CC=CC=CCCCCCCCCC=O.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 5.3.

How many hydrogen bond donor counts are there in the compound?

There are 0 hydrogen bond donor counts in the compound.

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

There is 1 hydrogen bond acceptor count in the compound.

How many rotatable bond counts are there in the compound?

There are 11 rotatable bond counts in the compound.

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