Molecular Weight of Phenylacetylglycine (C10H11NO3)
Identification of Phenylacetylglycine Chemical Compound
| Chemical Formula | C10H11NO3 |
|---|---|
| Molecular Weight | 193.19924 g/mol |
| IUPAC Name | 2-(2-phenylacetamido)acetic acid |
| SMILES String | OC(=O)CNC(=O)Cc1ccccc1 |
| InChI | 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) |
| InChIKey | UTYVDVLMYQPLQB-UHFFFAOYSA-N |
Molecular Weight Description
The Phenylacetylglycine molecule consists of 11 Hydrogen atom(s), 10 Carbon atom(s), 1 Nitrogen atom(s), and 3 Oxygen atom(s) - a total of 25 atom(s). The molecular weight of Phenylacetylglycine is determined by the sum of the atomic weights of each constituent element multiplied by the number of atoms, which is calculated to be:
$$ 193.19924 · \frac{g}{mol} $$
The exact term of the above molecular weight is “molar mass”, which is based on the atomic mass of each element. Molecular weight is actually an older term of “relative molar mass” or “molecular mass”, which is a dimensionless quantity equal to the molar mass divided by the molar mass constant defined by 1 g/mol.
Molecular masses are calculated from the standard atomic weights of each nuclide, while molar masses are calculated from the atomic mass of each element. The atomic mass takes into account the isotopic distribution of the element in a given sample.
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Additional Information for Identifying Phenylacetylglycine Molecule
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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 on atoms, bonds, connectivity and coordinates of Phenylacetylglycine. The Phenylacetylglycine structure data file can be imported to most of the chemistry-related software, providing three-dimensional visualization and further analysis.
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Chemical structure of Phenylacetylglycine
The molecular structure image of Phenylacetylglycine is available in chemical structure page of Phenylacetylglycine, which provides the molecular geometry information, i.e., the spatial arrangement of atoms in Phenylacetylglycine and the chemical bonds that hold the atoms together.
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Chemical formula of Phenylacetylglycine
The molecular formula of Phenylacetylglycine is given 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.
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InChI (IUPAC International Chemical Identifier) information of Phenylacetylglycine
In addition to the molecular weight information, the structural information of Phenylacetylglycine in a textual expression is available via InChi. The full standard InChI of Phenylacetylglycine is given below:
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)
It can provide a way to encode the molecular information of Phenylacetylglycine to facilitate the search for the compound information in databases and on the web.
The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of Phenylacetylglycine is:
InChIKey=UTYVDVLMYQPLQB-UHFFFAOYSA-N
It may allow easier web searches for Phenylacetylglycine. The InChIKey, however, needs to be linked to the full InChI as well in order to get back to the original structure of the Phenylacetylglycine as the full standard InChI cannot be reconstructed from the InChIKey.
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Other names (synonyms) or registry numbers of Phenylacetylglycine
There may be different names of the Phenylacetylglycine compound depending on the various situations of industrial applications, which are given below including the 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
Phenylacetylglycine Identification Summary Frequently Asked Questions (FAQs)
| What’s the formula of Phenylacetylglycine? |
|---|
| C10H11NO3 |
| How many atoms and what are the elements in 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 types of bonds are in 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 molar mass of Phenylacetylglycine? |
| 193.19924 g/mol |
| What’s the SMILES format of Phenylacetylglycine? |
| OC(=O)CNC(=O)Cc1ccccc1 |
| What’s the InChI format 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 string of Phenylacetylglycine? |
| UTYVDVLMYQPLQB-UHFFFAOYSA-N |
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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).