W (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate Structure - C20H30O3 - Over 100 million chemical compounds | Mol-Instincts
Home Structure (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate

Structure of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate (C20H30O3)

Identification of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate Chemical Compound

2D chemical structure image of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate
Chemical Formula C20H30O3
Molecular Weight 318.4504 g/mol
IUPAC Name (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate
SMILES String CC=CCC1=C(C)C(CC1=O)OC(=O)C2C(CC(C)C)C2(C)C
InChI InChI=1S/C20H30O3/c1-7-8-9-14-13(4)17(11-16(14)21)23-19(22)18-15(10-12(2)3)20(18,5)6/h7-8,12,15,17-18H,9-11H2,1-6H3/b8-7-/t15-,17+,18+/m1/s1
InChIKey JMDHWRPOSWALHN-DFKXKMKHSA-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 (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate molecule contains a total of 54 bond(s) There are 24 non-H bond(s), 4 multiple bond(s), 7 rotatable bond(s), 4 double bond(s), 1 three-membered ring(s), 1 five-membered ring(s), 1 ester(s) (aliphatic) and 1 ketone(s) (aliphatic).
Images of the chemical structure of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate are given below:

2D chemical structure image of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate
2-dimensional (2D) chemical structure image of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate
3D chemical structure image of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate
3-dimensional (3D) chemical structure image of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate

The 2D chemical structure image of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate 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 (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate 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 (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate.


An Interactive 3-dimensional (3D) Visualization of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate

For a better understanding of the chemical structure, an interactive 3D visualization of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate is provided here.

The (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate 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 (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate 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 (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate 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 a image file.





More Properties of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate

For physicochemical, thermodynamic, transport, spectra, and other property data & information, the followings are available from “Mol-Instincts”, a chemical database based on quantum mechanics:







Additional Information for Identifying (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate Molecule

  • Other names (synonyms) or registry numbers of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate

    The (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate including the various registry numbers, if available:



    None available.


Additional Outstanding Products

(1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate?
C20H30O3
How many atoms and what are the elements included the (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate molecule?
53 atom(s) - 30 Hydrogen atom(s), 20 Carbon atom(s) and 3 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate structure?
54 bond(s) - 24 non-H bond(s), 4 multiple bond(s), 7 rotatable bond(s), 4 double bond(s), 1 three-membered ring(s), 1 five-membered ring(s), 1 ester(s) (aliphatic) and 1 ketone(s) (aliphatic)
What’s the (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate’s molecular weight?
318.4504 g/mol
What’s the SMILES code of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate?
CC=CCC1=C(C)C(CC1=O)OC(=O)C2C(CC(C)C)C2(C)C
What’s the InChI string of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate?
InChI=1S/C20H30O3/c1-7-8-9-14-13(4)17(11-16(14)21)23-19(22)18-15(10-12(2)3)20(18,5)6/h7-8,12,15,17-18H,9-11H2,1-6H3/b8-7-/t15-,17+,18+/m1/s1
What’s the InChIKey code of (1S)-3-[(2Z)-but-2-en-1-yl]-2-methyl-4-oxocyclopent-2-en-1-yl (1R,3R)-2,2-dimethyl-3-(2-methylpropyl)cyclopropane-1-carboxylate?
JMDHWRPOSWALHN-DFKXKMKHSA-N

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