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Structure of 4-[(2-phenylethyl)amino]butyl benzoate (C19H23NO2)

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2D chemical structure image of 4-[(2-phenylethyl)amino]butyl benzoate
Chemical Formula C19H23NO2
Molecular Weight 297.39142 g/mol
IUPAC Name 4-[(2-phenylethyl)amino]butyl benzoate
SMILES String O=C(OCCCCNCCc1ccccc1)c2ccccc2
InChI InChI=1S/C19H23NO2/c21-19(18-11-5-2-6-12-18)22-16-8-7-14-20-15-13-17-9-3-1-4-10-17/h1-6,9-12,20H,7-8,13-16H2
InChIKey OXUYSDDDDMJPRZ-UHFFFAOYSA-N
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Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The 4-[(2-phenylethyl)amino]butyl benzoate molecule contains a total of 46 bond(s). There are 23 non-H bond(s), 13 multiple bond(s), 10 rotatable bond(s), 1 double bond(s), 12 aromatic bond(s), 2 six-membered ring(s), 1 ester(s) (aromatic), and 1 secondary amine(s) (aliphatic). Images of the chemical structure of 4-[(2-phenylethyl)amino]butyl benzoate are given below:

2D chemical structure image of 4-[(2-phenylethyl)amino]butyl benzoate
2-dimensional (2D) chemical structure image of 4-[(2-phenylethyl)amino]butyl benzoate
3D chemical structure image of 4-[(2-phenylethyl)amino]butyl benzoate
3-dimensional (3D) chemical structure image of 4-[(2-phenylethyl)amino]butyl benzoate

The 2D chemical structure image of 4-[(2-phenylethyl)amino]butyl benzoate is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 4-[(2-phenylethyl)amino]butyl benzoate 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 4-[(2-phenylethyl)amino]butyl benzoate 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 4-[(2-phenylethyl)amino]butyl benzoate. Download structure data file (SDF/MOL) file of this compound.


Interactive 3D Visualization

For a better understanding of the chemical structure, an interactive 3D visualization of 4-[(2-phenylethyl)amino]butyl benzoate is provided here.

The 4-[(2-phenylethyl)amino]butyl benzoate 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 4-[(2-phenylethyl)amino]butyl benzoate 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 4-[(2-phenylethyl)amino]butyl benzoate 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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  • CAS #: 64-17-5
  • Formula: C2H5OH
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  • InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N

Additional Information for Identifying 4-[(2-phenylethyl)amino]butyl benzoate Molecule

  • Other names (synonyms) or registry numbers of 4-[(2-phenylethyl)amino]butyl benzoate

    The 4-[(2-phenylethyl)amino]butyl benzoate compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of 4-[(2-phenylethyl)amino]butyl benzoate including the various registry numbers, if available:



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4-[(2-phenylethyl)amino]butyl benzoate Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 4-[(2-phenylethyl)amino]butyl benzoate?
C19H23NO2
How many atoms and what are the elements included the 4-[(2-phenylethyl)amino]butyl benzoate molecule?
45 atom(s) - 23 Hydrogen atom(s), 19 Carbon atom(s), 1 Nitrogen atom(s), and 2 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the 4-[(2-phenylethyl)amino]butyl benzoate structure?
46 bond(s) - 23 non-H bond(s), 13 multiple bond(s), 10 rotatable bond(s), 1 double bond(s), 12 aromatic bond(s), 2 six-membered ring(s), 1 ester(s) (aromatic), and 1 secondary amine(s) (aliphatic)
What’s the 4-[(2-phenylethyl)amino]butyl benzoate’s molecular weight?
297.39142 g/mol
What’s the SMILES code of 4-[(2-phenylethyl)amino]butyl benzoate?
O=C(OCCCCNCCc1ccccc1)c2ccccc2
What’s the InChI string of 4-[(2-phenylethyl)amino]butyl benzoate?
InChI=1S/C19H23NO2/c21-19(18-11-5-2-6-12-18)22-16-8-7-14-20-15-13-17-9-3-1-4-10-17/h1-6,9-12,20H,7-8,13-16H2
What’s the InChIKey code of 4-[(2-phenylethyl)amino]butyl benzoate?
OXUYSDDDDMJPRZ-UHFFFAOYSA-N