Structure & Deep Data of 6-methylnicotinaldehyde (C7H7NO)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The 6-methylnicotinaldehyde molecule contains a total of 16 bond(s). There are 9 non-H bond(s), 7 multiple bond(s), 1 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), 1 aldehyde(s) (aromatic), and 1 Pyridine(s). Images of the chemical structure of 6-methylnicotinaldehyde are given below:

The 2D chemical structure image of 6-methylnicotinaldehyde is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 6-methylnicotinaldehyde 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 6-methylnicotinaldehyde 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 6-methylnicotinaldehyde. Download structure data file (SDF/MOL) file of this compound.

---

chemical table area

Search Another Chemical Structure

Enter another compound to search for chemical structure:

Deep Data Application Examples

Our Deep Data encompasses property data, spectral data, quantum chemical data, and molecular descriptor data for a wide range of chemical compounds. It features more than 2,100 high-quality datasets per single chemical compound, totaling over 8 billion datasets for 4.1+ million chemical compounds. Below are some application examples that may interest you:

Additional Information for Identifying 6-methylnicotinaldehyde Molecule

• SMILES (Simplified Molecular-Input Line-Entry System) string of 6-methylnicotinaldehyde

  The SMILES string of 6-methylnicotinaldehyde is Cc1ccc(C=O)cn1, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the 6-methylnicotinaldehyde.

• Structure Data File (SDF/MOL File) of 6-methylnicotinaldehyde

  The structure data file (SDF/MOL File) of 6-methylnicotinaldehyde is available for download in the SDF page of 6-methylnicotinaldehyde, which provides the information about the atoms, bonds, connectivity and coordinates of 6-methylnicotinaldehyde. The 6-methylnicotinaldehyde structure data file can be imported to most of the cheminformatics software systems and applications.

• Chemical formula of 6-methylnicotinaldehyde

  The molecular formula of 6-methylnicotinaldehyde is available in chemical formula page of 6-methylnicotinaldehyde, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• Molecular weight of 6-methylnicotinaldehyde

  The molecular weight of 6-methylnicotinaldehyde is available in molecular weight page of 6-methylnicotinaldehyde, 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 6-methylnicotinaldehyde

  The 6-methylnicotinaldehyde compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of 6-methylnicotinaldehyde including the various registry numbers, if available:

  • EN300-52398
  • BBV-36831126
  • 6-methylnicotinaldehyde;6-Methyl-pyridine-3-carbaldehyde
  • J-518925
  • I02-0986
  • 3-Formyl-6-methylpyridine; 5-Formyl-2-picoline
  • C-1881
  • W6750
  • M2654
  • 5-Formyl-2-picoline/6-methylnicotinaldehyde

  • 4CH-004239
  • 6-Methylpyridine-3-carboxaldehyde, 97%
  • ANW-51652
  • CS-D0589
  • (6-methyl-pyridin-3-yl)-methanone
  • 6-methyl-3-pyridin-carboxaldehyde
  • 2-Methyl-5-pyridinecarboxaldehyde
  • 2-methylpyridine-5-carboxaldehyde
  • 6-methyl-3-pyridincarboxaldehyde
  • 2-methylpyridin-5-carboxaldehyde

  • 6-methyl-3-pyridinecarbaldehyde
  • 6-methyl-3-pyridine aldehyde
  • 2-methylpyridine-5-aldehyde
  • 6-methyl-3-formylpyridine
  • 6-methyl nicotinaldehyde
  • MFCD08272279
  • 6-METHYL-3-PYRIDINECARBOXALDEHYDE
  • 6-Methylpyridyl-3-carboxaldehyde
  • 3-PYRIDINECARBOXALDEHYDE, 6-METHYL-
  • 3-formyl-6-methylpyridine

  • 6-Methylpyridine-3-carboxaldehyde
  • 5-FORMYL-2-PICOLINE
  • 5-Formyl-2-methylpyridine
  • 3-Formyl-6-Methyl-Pyridine
  • 6-Methyl-pyridine-3-carbaldehyde
  • 2-Methyl-5-formylpyridine
  • 53014-84-9
  • 6-methylnicotinaldehyde

---

6-methylnicotinaldehyde Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 6-methylnicotinaldehyde?
C7H7NO
How many atoms and what are the elements included the 6-methylnicotinaldehyde molecule?
16 atom(s) - 7 Hydrogen atom(s), 7 Carbon atom(s), 1 Nitrogen atom(s), and 1 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the 6-methylnicotinaldehyde structure?
16 bond(s) - 9 non-H bond(s), 7 multiple bond(s), 1 rotatable bond(s), 1 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), 1 aldehyde(s) (aromatic), and 1 Pyridine(s)
What’s the 6-methylnicotinaldehyde’s molecular weight?
121.13658 g/mol
What’s the SMILES code of 6-methylnicotinaldehyde?
Cc1ccc(C=O)cn1
What’s the InChI string of 6-methylnicotinaldehyde?
InChI=1S/C7H7NO/c1-6-2-3-7(5-9)4-8-6/h2-5H,1H3
What’s the InChIKey code of 6-methylnicotinaldehyde?
IMWMEIWYPWVABQ-UHFFFAOYSA-N

58 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).