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Structure

3-Hexene-2,5-dione,3-methyl-,(3Z)-(9ci)

CAS
97204-34-7
Catalog Number
ACM97204347
Category
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What is the molecular formula of 3-Hexene-2,5-dione,3-methyl-, (3Z)-(9ci)?

The molecular formula is C7H10O2.

When was this compound first created?

This compound was first created on 2007-12-06.

What is the computed IUPAC Name of this compound?

The computed IUPAC Name is (Z)-3-methylhex-3-ene-2,5-dione.

What is the Canonical SMILES of this compound?

The Canonical SMILES is CC(=CC(=O)C)C(=O)C.

What is the XLogP3-AA value of this compound?

The XLogP3-AA value is 0.2.

How many hydrogen bond acceptor counts does this compound have?

This compound has 2 hydrogen bond acceptor counts.

What is the exact mass of this compound?

The exact mass is 126.068079557 g/mol.

How many heavy atoms are present in this compound?

There are 9 heavy atoms present in this compound.

Does this compound have any defined bond stereocenter count?

Yes, this compound has 1 defined bond stereocenter count.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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