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97199-26-3 Purity
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97199-26-3 Purity
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3-Hexene-2,5-dione,3-methyl-,(3Z)-(9ci)
CAS
97204-34-7
Catalog Number
ACM97204347
Category
Other Products
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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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