Home Structure This Compound
loading

Structure & Deep Data of SUCCINONITRILE (C4H4N2)

Identification of SUCCINONITRILE Chemical Compound

2D chemical structure image of SUCCINONITRILE
Chemical Formula C4H4N2
Molecular Weight 80.08796 g/mol
IUPAC Name butanedinitrile
SMILES String N#CCCC#N
InChI InChI=1S/C4H4N2/c5-3-1-2-4-6/h1-2H2
InChIKey IAHFWCOBPZCAEA-UHFFFAOYSA-N

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The SUCCINONITRILE molecule contains a total of 9 bond(s). There are 5 non-H bond(s), 2 multiple bond(s), 1 rotatable bond(s), 2 triple bond(s), and 2 nitrile(s) (aliphatic). Images of the chemical structure of SUCCINONITRILE are given below:

2D chemical structure image of SUCCINONITRILE
2-dimensional (2D) chemical structure image of SUCCINONITRILE
3D chemical structure image of SUCCINONITRILE
3-dimensional (3D) chemical structure image of SUCCINONITRILE

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


chemical table area

loading image

Interactive 3D Visualization

For a better understanding of the chemical structure, an interactive 3D visualization of SUCCINONITRILE is provided here.

The SUCCINONITRILE molecule shown in the visualization screen can be rotated interactively by keep clicking and moving the mouse button. Mouse wheel zoom is available as well – the size of the SUCCINONITRILE molecule can be increased or decreased by scrolling the mouse wheel.

The information of the atoms, bonds, connectivity and coordinates included in the chemical structure of SUCCINONITRILE can easily be identified by this visualization. By right-clicking the visualization screen, various other options are available including the visualization of van der Waals surface and exporting to an image file.


Search Another Chemical Structure

Enter another compound to search for chemical structure:

Input a chemical compound consisting of C, H, N, O, S, F, Cl, Br, I, Si, P, and/or As atom(s)

Input example for Ethanol:

  • Name: ethanol
  • CAS #: 64-17-5
  • Formula: C2H5OH
  • Smiles: CCO
  • InChI: InChI=1S/C2H6O/c1-2-3/h3H,2H2,1H3
  • InChIKey: LFQSCWFLJHTTHZ-UHFFFAOYSA-N

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 SUCCINONITRILE Molecule

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

    The SMILES string of SUCCINONITRILE is N#CCCC#N, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the SUCCINONITRILE.

  • Structure Data File (SDF/MOL File) of SUCCINONITRILE

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

  • Chemical formula of SUCCINONITRILE

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

  • Molecular weight of SUCCINONITRILE

    The molecular weight of SUCCINONITRILE is available in molecular weight page of SUCCINONITRILE, 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 SUCCINONITRILE

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

    • BBV-34552768
    • AR-1L5711
    • 191362-21-7
    • F0001-0221
    • Q-201749
    • I14-3315
    • EN300-35675
    • S0109
    • Succinonitrile, purum, >=97.0% (GC)
    • CAS-110-61-2
    • RTR-034032
    • MFCD00001949
    • ANW-16173
    • 1R479O92DO
    • Jsp000810
    • ETHYL, 1,2-DICYANO-
    • Succinonitrile, 98% 100g
    • ethane-1,2-dicarbonitrile
    • NCCH2CH2CN
    • Succinonitrile, 99%
    • Ethane,2-dicyano-
    • Dicyanoethane
    • 1,2-dicyano-ethan
    • sym-Dicyanoethane
    • Sukcinonitril [Czech]
    • USAF A-9442
    • Ethane, 1,2-dicyano-
    • Sukcinonitril
    • Succinic acid dinitrile
    • Succinic acid nitrile
    • Succinic dinitrile
    • 1,4-Butanedinitrile
    • s-Dicyanoethane
    • Suxil
    • Evanex
    • Succinil
    • Disuxyl
    • Ethylene dicyanide
    • 1,2-Dicyanoethane
    • Succinodinitrile
    • Dinile
    • Dician
    • Ethylene cyanide
    • Deprelin
    • 110-61-2
    • SUCCINONITRILE

SUCCINONITRILE Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of SUCCINONITRILE?
C4H4N2
How many atoms and what are the elements included the SUCCINONITRILE molecule?
10 atom(s) - 4 Hydrogen atom(s), 4 Carbon atom(s), and 2 Nitrogen atom(s)
How many chemical bonds and what kind of bonds are included the SUCCINONITRILE structure?
9 bond(s) - 5 non-H bond(s), 2 multiple bond(s), 1 rotatable bond(s), 2 triple bond(s), and 2 nitrile(s) (aliphatic)
What’s the SUCCINONITRILE’s molecular weight?
80.08796 g/mol
What’s the SMILES code of SUCCINONITRILE?
N#CCCC#N
What’s the InChI string of SUCCINONITRILE?
InChI=1S/C4H4N2/c5-3-1-2-4-6/h1-2H2
What’s the InChIKey code of SUCCINONITRILE?
IAHFWCOBPZCAEA-UHFFFAOYSA-N

2948 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).

Subscribe to our newsletter

Join our subscribers list to get the latest news, updates and special offers delivered directly in your inbox.