Structure & Deep Data of Isobutyl iodide (C4H9I)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The Isobutyl iodide molecule contains a total of 13 bond(s). There are 4 non-H bond(s). Images of the chemical structure of Isobutyl iodide are given below:

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

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Additional Information for Identifying Isobutyl iodide Molecule

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

  The SMILES string of Isobutyl iodide is CC(C)CI, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the Isobutyl iodide.

• Structure Data File (SDF/MOL File) of Isobutyl iodide

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

• Chemical formula of Isobutyl iodide

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

• Molecular weight of Isobutyl iodide

  The molecular weight of Isobutyl iodide is available in molecular weight page of Isobutyl iodide, 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 Isobutyl iodide

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

  • 1-Iodo-2-methylpropane, contains copper as stabilizer, 97%
  • F2190-0185
  • I14-17194
  • J-802035
  • A828543
  • I0322
  • RTR-018296
  • 82IJ6B9708
  • MFCD00001084
  • ANW-42898

  • PROPANE, 1-IODO-2-METHYL
  • 1-iodanyl-2-methyl-propane
  • Propane,1-iodo-2-methyl-
  • 1-IODO-ISO-BUTANE
  • 1-IODOMETHYLPROPANE
  • 3-iodo-2-methylpropane
  • BBV-42302688
  • iso-C4H9I
  • sJPHAVIKUP@
  • Iodo-2-methylpropane

  • 2-methyl-iodopropane
  • 2-methylpropyliodide
  • 1-iodoisobutane
  • isobutyl iodine
  • iodoisobutane
  • 1-iodo-2-methyl-propane
  • 1-iodo-2-methyl propane
  • 1-Jod-2-methylpropan [Czech]
  • iso-butyl iodide
  • 1-Jod-2-methylpropan

  • isobutyliodide
  • Isobutyljodid [Czech]
  • 2-Methylpropyl iodide
  • Primary isobutyl iodide
  • Isobutyljodid
  • Propane, 1-iodo-2-methyl-
  • 513-38-2
  • Isobutyl iodide

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Isobutyl iodide Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of Isobutyl iodide?
C4H9I
How many atoms and what are the elements included the Isobutyl iodide molecule?
14 atom(s) - 9 Hydrogen atom(s), 4 Carbon atom(s), and 1 Iodine atom(s)
How many chemical bonds and what kind of bonds are included the Isobutyl iodide structure?
13 bond(s) - 4 non-H bond(s)
What’s the Isobutyl iodide’s molecular weight?
184.01873 g/mol
What’s the SMILES code of Isobutyl iodide?
CC(C)CI
What’s the InChI string of Isobutyl iodide?
InChI=1S/C4H9I/c1-4(2)3-5/h4H,3H2,1-2H3
What’s the InChIKey code of Isobutyl iodide?
BTUGGGLMQBJCBN-UHFFFAOYSA-N

11858 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).