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Structure & Deep Data of 5-(4-hydroxyphenyl)pentanoic Acid (C11H14O3)

Identification of 5-(4-hydroxyphenyl)pentanoic Acid Chemical Compound

2D chemical structure image of 5-(4-hydroxyphenyl)pentanoic Acid
Chemical Formula C11H14O3
Molecular Weight 194.22706 g/mol
IUPAC Name 5-(4-hydroxyphenyl)pentanoic acid
SMILES String OC(=O)CCCCc1ccc(O)cc1
InChI InChI=1S/C11H14O3/c12-10-7-5-9(6-8-10)3-1-2-4-11(13)14/h5-8,12H,1-4H2,(H,13,14)
InChIKey YSSJQFONKASLKM-UHFFFAOYSA-N

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The 5-(4-hydroxyphenyl)pentanoic Acid molecule contains a total of 28 bond(s). There are 14 non-H bond(s), 7 multiple bond(s), 5 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), 1 carboxylic acid(s) (aliphatic), 1 hydroxyl group(s), and 1 aromatic hydroxyl(s). Images of the chemical structure of 5-(4-hydroxyphenyl)pentanoic Acid are given below:

2D chemical structure image of 5-(4-hydroxyphenyl)pentanoic Acid
2-dimensional (2D) chemical structure image of 5-(4-hydroxyphenyl)pentanoic Acid
3D chemical structure image of 5-(4-hydroxyphenyl)pentanoic Acid
3-dimensional (3D) chemical structure image of 5-(4-hydroxyphenyl)pentanoic Acid

The 2D chemical structure image of 5-(4-hydroxyphenyl)pentanoic Acid is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 5-(4-hydroxyphenyl)pentanoic Acid are implied to be located at the corner(s) and hydrogen atoms attached to carbon atoms are not indicated – each carbon atom is considered to be associated with enough hydrogen atoms to provide the carbon atom with four bonds.

The 3D chemical structure image of 5-(4-hydroxyphenyl)pentanoic Acid is based on the ball-and-stick model which displays both the three-dimensional position of the atoms and the bonds between them. The radius of the spheres is therefore smaller than the rod lengths in order to provide a clearer view of the atoms and bonds throughout the chemical structure model of 5-(4-hydroxyphenyl)pentanoic Acid. Download structure data file (SDF/MOL) file of this compound.


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Interactive 3D Visualization

For a better understanding of the chemical structure, an interactive 3D visualization of 5-(4-hydroxyphenyl)pentanoic Acid is provided here.

The 5-(4-hydroxyphenyl)pentanoic Acid molecule shown in the visualization screen can be rotated interactively by keep clicking and moving the mouse button. Mouse wheel zoom is available as well – the size of the 5-(4-hydroxyphenyl)pentanoic Acid molecule can be increased or decreased by scrolling the mouse wheel.

The information of the atoms, bonds, connectivity and coordinates included in the chemical structure of 5-(4-hydroxyphenyl)pentanoic Acid can easily be identified by this visualization. By right-clicking the visualization screen, various other options are available including the visualization of van der Waals surface and exporting to an image file.


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Additional Information for Identifying 5-(4-hydroxyphenyl)pentanoic Acid Molecule

  • Other names (synonyms) or registry numbers of 5-(4-hydroxyphenyl)pentanoic Acid

    The 5-(4-hydroxyphenyl)pentanoic Acid compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of 5-(4-hydroxyphenyl)pentanoic Acid including the various registry numbers, if available:

    • I14-105541
    • MFCD04039777
    • 5-(4-Hydroxyphenyl)valeric acid
    • 4654-08-4

5-(4-hydroxyphenyl)pentanoic Acid Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 5-(4-hydroxyphenyl)pentanoic Acid?
C11H14O3
How many atoms and what are the elements included the 5-(4-hydroxyphenyl)pentanoic Acid molecule?
28 atom(s) - 14 Hydrogen atom(s), 11 Carbon atom(s), and 3 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the 5-(4-hydroxyphenyl)pentanoic Acid structure?
28 bond(s) - 14 non-H bond(s), 7 multiple bond(s), 5 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), 1 carboxylic acid(s) (aliphatic), 1 hydroxyl group(s), and 1 aromatic hydroxyl(s)
What’s the 5-(4-hydroxyphenyl)pentanoic Acid’s molecular weight?
194.22706 g/mol
What’s the SMILES code of 5-(4-hydroxyphenyl)pentanoic Acid?
OC(=O)CCCCc1ccc(O)cc1
What’s the InChI string of 5-(4-hydroxyphenyl)pentanoic Acid?
InChI=1S/C11H14O3/c12-10-7-5-9(6-8-10)3-1-2-4-11(13)14/h5-8,12H,1-4H2,(H,13,14)
What’s the InChIKey code of 5-(4-hydroxyphenyl)pentanoic Acid?
YSSJQFONKASLKM-UHFFFAOYSA-N

40 The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).

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