Structure & Deep Data of Stauffer R-10669 (C11H12N2O7)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The Stauffer R-10669 molecule contains a total of 32 bond(s). There are 20 non-H bond(s), 11 multiple bond(s), 8 rotatable bond(s), 5 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), 1 carbonate (-thio) derivative(s), and 2 nitro group(s) (aromatic). Images of the chemical structure of Stauffer R-10669 are given below:

The 2D chemical structure image of Stauffer R-10669 is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of Stauffer R-10669 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 Stauffer R-10669 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 Stauffer R-10669. Download structure data file (SDF/MOL) file of this compound.

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Additional Information for Identifying Stauffer R-10669 Molecule

• SMILES (Simplified Molecular-Input Line-Entry System) string of Stauffer R-10669

  The SMILES string of Stauffer R-10669 is CCCCOC(=O)Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the Stauffer R-10669.

• Structure Data File (SDF/MOL File) of Stauffer R-10669

  The structure data file (SDF/MOL File) of Stauffer R-10669 is available for download in the SDF page of Stauffer R-10669, which provides the information about the atoms, bonds, connectivity and coordinates of Stauffer R-10669. The Stauffer R-10669 structure data file can be imported to most of the cheminformatics software systems and applications.

• Chemical formula of Stauffer R-10669

  The molecular formula of Stauffer R-10669 is available in chemical formula page of Stauffer R-10669, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• Molecular weight of Stauffer R-10669

  The molecular weight of Stauffer R-10669 is available in molecular weight page of Stauffer R-10669, 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 Stauffer R-10669

  The Stauffer R-10669 compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of Stauffer R-10669 including the various registry numbers, if available:

  • Butyl-2,4-dinitrofenylester kyseliny uhlicite
  • 15741-91-0
  • Butyl-2,4-dinitrofenylester kyseliny uhlicite [Czech]
  • CARBONIC ACID, BUTYL 2,4-DINITROPHENYL ESTER
  • ENT 27,364
  • R-10669
  • Butyl 2,4-dinitrophenyl carbonate
  • Stauffer R-10669

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Stauffer R-10669 Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of Stauffer R-10669?
C11H12N2O7
How many atoms and what are the elements included the Stauffer R-10669 molecule?
32 atom(s) - 12 Hydrogen atom(s), 11 Carbon atom(s), 2 Nitrogen atom(s), and 7 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the Stauffer R-10669 structure?
32 bond(s) - 20 non-H bond(s), 11 multiple bond(s), 8 rotatable bond(s), 5 double bond(s), 6 aromatic bond(s), 1 six-membered ring(s), 1 carbonate (-thio) derivative(s), and 2 nitro group(s) (aromatic)
What’s the Stauffer R-10669’s molecular weight?
284.22218 g/mol
What’s the SMILES code of Stauffer R-10669?
CCCCOC(=O)Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O
What’s the InChI string of Stauffer R-10669?
InChI=1S/C11H12N2O7/c1-2-3-6-19-11(14)20-10-5-4-8(12(15)16)7-9(10)13(17)18/h4-5,7H,2-3,6H2,1H3
What’s the InChIKey code of Stauffer R-10669?
UKVCWXQPMRARHZ-UHFFFAOYSA-N

25 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).