Structure & Deep Data of Fmoc-1-piperidine-3-acetic acid (C22H23NO4)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The Fmoc-1-piperidine-3-acetic acid molecule contains a total of 53 bond(s). There are 30 non-H bond(s), 14 multiple bond(s), 5 rotatable bond(s), 2 double bond(s), 12 aromatic bond(s), 1 five-membered ring(s), 3 six-membered ring(s), 2 nine-membered ring(s), 1 carboxylic acid(s) (aliphatic), 1 (thio-) carbamate(s) (aliphatic), and 1 hydroxyl group(s). Images of the chemical structure of Fmoc-1-piperidine-3-acetic acid are given below:

The 2D chemical structure image of Fmoc-1-piperidine-3-acetic acid is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of Fmoc-1-piperidine-3-acetic 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 Fmoc-1-piperidine-3-acetic 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 Fmoc-1-piperidine-3-acetic acid. Download structure data file (SDF/MOL) file of this compound.

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Additional Information for Identifying Fmoc-1-piperidine-3-acetic acid Molecule

• SMILES (Simplified Molecular-Input Line-Entry System) string of Fmoc-1-piperidine-3-acetic acid

  The SMILES string of Fmoc-1-piperidine-3-acetic acid is OC(=O)CC1CCCN(C1)C(=O)OCC3c2ccccc2c4ccccc34, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the Fmoc-1-piperidine-3-acetic acid.

• Structure Data File (SDF/MOL File) of Fmoc-1-piperidine-3-acetic acid

  The structure data file (SDF/MOL File) of Fmoc-1-piperidine-3-acetic acid is available for download in the SDF page of Fmoc-1-piperidine-3-acetic acid, which provides the information about the atoms, bonds, connectivity and coordinates of Fmoc-1-piperidine-3-acetic acid. The Fmoc-1-piperidine-3-acetic acid structure data file can be imported to most of the cheminformatics software systems and applications.

• Chemical formula of Fmoc-1-piperidine-3-acetic acid

  The molecular formula of Fmoc-1-piperidine-3-acetic acid is available in chemical formula page of Fmoc-1-piperidine-3-acetic acid, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• Molecular weight of Fmoc-1-piperidine-3-acetic acid

  The molecular weight of Fmoc-1-piperidine-3-acetic acid is available in molecular weight page of Fmoc-1-piperidine-3-acetic acid, 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 Fmoc-1-piperidine-3-acetic acid

  The Fmoc-1-piperidine-3-acetic 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 Fmoc-1-piperidine-3-acetic acid including the various registry numbers, if available:

  • 2-[1-(9H-fluoren-9-ylmethoxycarbonyl)piperidin-3-yl]acetic acid
  • Fmoc-1-piperidine-3-acetic acid, AldrichCPR
  • 1876AF
  • {1-[(9H-fluoren-9-ylmethoxy)carbonyl]piperidin-3-yl}acetic acid
  • N-FMOC-3-PIPERIDINEACETIC ACID
  • 885951-96-2
  • Fmoc-1-piperidine-3-acetic acid

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Fmoc-1-piperidine-3-acetic acid Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of Fmoc-1-piperidine-3-acetic acid?
C22H23NO4
How many atoms and what are the elements included the Fmoc-1-piperidine-3-acetic acid molecule?
50 atom(s) - 23 Hydrogen atom(s), 22 Carbon atom(s), 1 Nitrogen atom(s), and 4 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the Fmoc-1-piperidine-3-acetic acid structure?
53 bond(s) - 30 non-H bond(s), 14 multiple bond(s), 5 rotatable bond(s), 2 double bond(s), 12 aromatic bond(s), 1 five-membered ring(s), 3 six-membered ring(s), 2 nine-membered ring(s), 1 carboxylic acid(s) (aliphatic), 1 (thio-) carbamate(s) (aliphatic), and 1 hydroxyl group(s)
What’s the Fmoc-1-piperidine-3-acetic acid’s molecular weight?
365.42232 g/mol
What’s the SMILES code of Fmoc-1-piperidine-3-acetic acid?
OC(=O)CC1CCCN(C1)C(=O)OCC3c2ccccc2c4ccccc34
What’s the InChI string of Fmoc-1-piperidine-3-acetic acid?
InChI=1S/C22H23NO4/c24-21(25)12-15-6-5-11-23(13-15)22(26)27-14-20-18-9-3-1-7-16(18)17-8-2-4-10-19(17)20/h1-4,7-10,15,20H,5-6,11-14H2,(H,24,25)
What’s the InChIKey code of Fmoc-1-piperidine-3-acetic acid?
JFQZUENRKJILBT-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).