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Structure

4-Oxoheptanoic acid

CAS
924-97-0
Catalog Number
ACM924970
Category
Other Products
Molecular Weight
144.17
Molecular Formula
C7H12O3

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Specification

Synonyms
4-OXOHEPTANOIC ACID;4-Ketoenanthic acid
IUPAC Name
4-oxoheptanoic acid
Canonical SMILES
CCCC(=O)CCC(=O)O
InChI Key
ACHSNZNVVUIPJX-UHFFFAOYSA-N
Boiling Point
268.7ºC at 760 mmHg
Flash Point
130.6ºC
Density
1.061g/cm³
Exact Mass
144.07900
H-Bond Acceptor
3
H-Bond Donor
1
What is the molecular formula of 4-Oxoheptanoic acid?

The molecular formula of 4-Oxoheptanoic acid is C7H12O3.

What is the molecular weight of 4-Oxoheptanoic acid?

The molecular weight of 4-Oxoheptanoic acid is 144.17 g/mol.

When was 4-Oxoheptanoic acid created?

4-Oxoheptanoic acid was created on January 13, 2006.

What is the IUPAC name of 4-Oxoheptanoic acid?

The IUPAC name of 4-Oxoheptanoic acid is 4-oxoheptanoic acid.

What is the InChI of 4-Oxoheptanoic acid?

The InChI of 4-Oxoheptanoic acid is InChI=1S/C7H12O3/c1-2-3-6(8)4-5-7(9)10/h2-5H2,1H3,(H,9,10).

What is the Canonical SMILES of 4-Oxoheptanoic acid?

The Canonical SMILES of 4-Oxoheptanoic acid is CCCC(=O)CCC(=O)O.

What is the CAS number of 4-Oxoheptanoic acid?

The CAS number of 4-Oxoheptanoic acid is 924-97-0.

What is the XLogP3-AA value of 4-Oxoheptanoic acid?

The XLogP3-AA value of 4-Oxoheptanoic acid is 0.2.

How many hydrogen bond donor count does 4-Oxoheptanoic acid have?

4-Oxoheptanoic acid has 1 hydrogen bond donor count.

How many rotatable bond count does 4-Oxoheptanoic acid have?

4-Oxoheptanoic acid has 5 rotatable bond count.

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