Structure & Deep Data of Benzo[d]oxazol-6-amine (C7H6N2O)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The benzo[d]oxazol-6-amine molecule contains a total of 17 bond(s). There are 11 non-H bond(s), 10 multiple bond(s), 10 aromatic bond(s), 1 five-membered ring(s), 1 six-membered ring(s), 1 nine-membered ring(s), 1 primary amine(s) (aromatic), and 1 Oxazole(s). Images of the chemical structure of benzo[d]oxazol-6-amine are given below:

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

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Additional Information for Identifying Benzo[d]oxazol-6-amine Molecule

• SMILES (Simplified Molecular-Input Line-Entry System) string of benzo[d]oxazol-6-amine

  The SMILES string of benzo[d]oxazol-6-amine is Nc2ccc1ncoc1c2, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the benzo[d]oxazol-6-amine.

• Structure Data File (SDF/MOL File) of benzo[d]oxazol-6-amine

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

• Chemical formula of benzo[d]oxazol-6-amine

  The molecular formula of benzo[d]oxazol-6-amine is available in chemical formula page of benzo[d]oxazol-6-amine, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• Molecular weight of benzo[d]oxazol-6-amine

  The molecular weight of benzo[d]oxazol-6-amine is available in molecular weight page of benzo[d]oxazol-6-amine, 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 benzo[d]oxazol-6-amine

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

  • Z1741972720
  • I14-10769
  • J-519731
  • J-011288
  • W3873
  • 4CH-014406
  • BBV-32475555
  • RTC-063696
  • 1,3-benzoxazol-6-amine, AldrichCPR
  • AR-1H0990

  • ANW-50565
  • 1,3-Benzoxazol-6-amine #
  • 6-amino-1,3-benzoxazole
  • benzoxazole-6-ylamine
  • 6-amino-benzoxazole
  • MFCD03791187
  • Benzooxazol-6-ylamine
  • 6-Aminobenzoxazole
  • 6-benzoxazolamine
  • 177492-52-3

  • benzo[d]oxazol-6-amine
  • S-4811
  • 2P-046
  • EN300-74661

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Benzo[d]oxazol-6-amine Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of benzo[d]oxazol-6-amine?
C7H6N2O
How many atoms and what are the elements included the benzo[d]oxazol-6-amine molecule?
16 atom(s) - 6 Hydrogen atom(s), 7 Carbon atom(s), 2 Nitrogen atom(s), and 1 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the benzo[d]oxazol-6-amine structure?
17 bond(s) - 11 non-H bond(s), 10 multiple bond(s), 10 aromatic bond(s), 1 five-membered ring(s), 1 six-membered ring(s), 1 nine-membered ring(s), 1 primary amine(s) (aromatic), and 1 Oxazole(s)
What’s the benzo[d]oxazol-6-amine’s molecular weight?
134.13534 g/mol
What’s the SMILES code of benzo[d]oxazol-6-amine?
Nc2ccc1ncoc1c2
What’s the InChI string of benzo[d]oxazol-6-amine?
InChI=1S/C7H6N2O/c8-5-1-2-6-7(3-5)10-4-9-6/h1-4H,8H2
What’s the InChIKey code of benzo[d]oxazol-6-amine?
ZJYIRVSPPOOPCL-UHFFFAOYSA-N

22 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).