Structure & Deep Data of Phenylacetylglycine (C10H11NO3)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The Phenylacetylglycine molecule contains a total of 25 bond(s). There are 14 non-H bond(s), 8 multiple bond(s), 4 rotatable bond(s), 2 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), 1 carboxylic acid(s) (aliphatic), 1 secondary amide(s) (aliphatic), and 1 hydroxyl group(s). Images of the chemical structure of Phenylacetylglycine are given below:

The 2D chemical structure image of Phenylacetylglycine is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of Phenylacetylglycine 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 Phenylacetylglycine 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 Phenylacetylglycine. Download structure data file (SDF/MOL) file of this compound.

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Additional Information for Identifying Phenylacetylglycine Molecule

• SMILES (Simplified Molecular-Input Line-Entry System) string of Phenylacetylglycine

  The SMILES string of Phenylacetylglycine is OC(=O)CNC(=O)Cc1ccccc1, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the Phenylacetylglycine.

• Structure Data File (SDF/MOL File) of Phenylacetylglycine

  The structure data file (SDF/MOL File) of Phenylacetylglycine is available for download in the SDF page of Phenylacetylglycine, which provides the information about the atoms, bonds, connectivity and coordinates of Phenylacetylglycine. The Phenylacetylglycine structure data file can be imported to most of the cheminformatics software systems and applications.

• Chemical formula of Phenylacetylglycine

  The molecular formula of Phenylacetylglycine is available in chemical formula page of Phenylacetylglycine, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• Molecular weight of Phenylacetylglycine

  The molecular weight of Phenylacetylglycine is available in molecular weight page of Phenylacetylglycine, which is calculated as the sum of the atomic weights of each constituent element multiplied by the number of atoms of that element in the molecular formula.

• Other names (synonyms) or registry numbers of Phenylacetylglycine

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

  • T5432838
  • N-(2-Phenylacetyl)glycine, >=98.0% (qNMR)
  • AR-1L0604
  • N-(2-Phenylacetyl)glycine, analytical reference material
  • P0131
  • BBV-091855
  • MFCD00021744
  • ANW-43283
  • 4350AE
  • ZX-AN035468

  • ALBB-019765
  • [(Phenylacetyl)amino]acetic acid #
  • HMS1433M15
  • HMDB00821
  • PHENACETURIC ACID 99+%
  • O134PDX2SP
  • Cambridge id 5117723
  • Epitope ID:161307
  • bmse000658
  • N-(phenylacetyl)-Glycine

  • phenylacetyl glycine
  • Phenylac-Gly-OH
  • Phenaceturate
  • 2-(2-phenylacetylamino)acetic acid
  • [(phenylacetyl)amino]acetate
  • [(Phenylacetyl)amino]acetic acid
  • ((phenylacetyl)amino)acetic acid
  • 2-[(2-phenylacetyl)amino]acetic acid
  • Glycine, N-(phenylacetyl)-
  • N-(Phenylacetyl)glycine

  • N-Phenacetylglycine
  • 500-98-1
  • N-Phenylacetylglycine
  • Phenacetylglycine
  • Phenaceturic acid
  • Phenylacetylglycine

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Phenylacetylglycine Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of Phenylacetylglycine?
C10H11NO3
How many atoms and what are the elements included the Phenylacetylglycine molecule?
25 atom(s) - 11 Hydrogen atom(s), 10 Carbon atom(s), 1 Nitrogen atom(s), and 3 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the Phenylacetylglycine structure?
25 bond(s) - 14 non-H bond(s), 8 multiple bond(s), 4 rotatable bond(s), 2 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), 1 carboxylic acid(s) (aliphatic), 1 secondary amide(s) (aliphatic), and 1 hydroxyl group(s)
What’s the Phenylacetylglycine’s molecular weight?
193.19924 g/mol
What’s the SMILES code of Phenylacetylglycine?
OC(=O)CNC(=O)Cc1ccccc1
What’s the InChI string of Phenylacetylglycine?
InChI=1S/C10H11NO3/c12-9(11-7-10(13)14)6-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)(H,13,14)
What’s the InChIKey code of Phenylacetylglycine?
UTYVDVLMYQPLQB-UHFFFAOYSA-N

45 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).