Structure & Deep Data of Methyl indolizine-7-carboxylate (C10H9NO2)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The methyl indolizine-7-carboxylate molecule contains a total of 23 bond(s). There are 14 non-H bond(s), 11 multiple bond(s), 2 rotatable bond(s), 1 double bond(s), 10 aromatic bond(s), 1 five-membered ring(s), 1 six-membered ring(s), 1 nine-membered ring(s), 1 ester(s) (aromatic), 1 Pyrrole(s), and 1 Pyridine(s). Images of the chemical structure of methyl indolizine-7-carboxylate are given below:

The 2D chemical structure image of methyl indolizine-7-carboxylate is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of methyl indolizine-7-carboxylate 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 methyl indolizine-7-carboxylate 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 methyl indolizine-7-carboxylate. Download structure data file (SDF/MOL) file of this compound.

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Additional Information for Identifying Methyl indolizine-7-carboxylate Molecule

• SMILES (Simplified Molecular-Input Line-Entry System) string of methyl indolizine-7-carboxylate

  The SMILES string of methyl indolizine-7-carboxylate is COC(=O)c2ccn1cccc1c2, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the methyl indolizine-7-carboxylate.

• Structure Data File (SDF/MOL File) of methyl indolizine-7-carboxylate

  The structure data file (SDF/MOL File) of methyl indolizine-7-carboxylate is available for download in the SDF page of methyl indolizine-7-carboxylate, which provides the information about the atoms, bonds, connectivity and coordinates of methyl indolizine-7-carboxylate. The methyl indolizine-7-carboxylate structure data file can be imported to most of the cheminformatics software systems and applications.

• Chemical formula of methyl indolizine-7-carboxylate

  The molecular formula of methyl indolizine-7-carboxylate is available in chemical formula page of methyl indolizine-7-carboxylate, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• Molecular weight of methyl indolizine-7-carboxylate

  The molecular weight of methyl indolizine-7-carboxylate is available in molecular weight page of methyl indolizine-7-carboxylate, 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 methyl indolizine-7-carboxylate

  The methyl indolizine-7-carboxylate compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of methyl indolizine-7-carboxylate including the various registry numbers, if available:

  • J-522609
  • I14-3042
  • A842888
  • S-6125
  • W9179
  • 4CH-007500
  • 7-Indolizinecarboxylicacid, methyl ester
  • 7-indolizinecarboxylic acid methyl ester
  • MFCD10566763
  • ANW-50357

  • ZX-RL000014
  • 7-Indolizinecarboxylic acid, methyl ester
  • 887602-89-3

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Methyl indolizine-7-carboxylate Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of methyl indolizine-7-carboxylate?
C10H9NO2
How many atoms and what are the elements included the methyl indolizine-7-carboxylate molecule?
22 atom(s) - 9 Hydrogen atom(s), 10 Carbon atom(s), 1 Nitrogen atom(s), and 2 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the methyl indolizine-7-carboxylate structure?
23 bond(s) - 14 non-H bond(s), 11 multiple bond(s), 2 rotatable bond(s), 1 double bond(s), 10 aromatic bond(s), 1 five-membered ring(s), 1 six-membered ring(s), 1 nine-membered ring(s), 1 ester(s) (aromatic), 1 Pyrrole(s), and 1 Pyridine(s)
What’s the methyl indolizine-7-carboxylate’s molecular weight?
175.18396 g/mol
What’s the SMILES code of methyl indolizine-7-carboxylate?
COC(=O)c2ccn1cccc1c2
What’s the InChI string of methyl indolizine-7-carboxylate?
InChI=1S/C10H9NO2/c1-13-10(12)8-4-6-11-5-2-3-9(11)7-8/h2-7H,1H3
What’s the InChIKey code of methyl indolizine-7-carboxylate?
BVQIGDNWKHPLOE-UHFFFAOYSA-N

27 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).