Structure & Deep Data of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane (C13H22N2O2)

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane molecule contains a total of 40 bond(s). There are 18 non-H bond(s), 2 multiple bond(s), 4 rotatable bond(s), 2 double bond(s), 2 five-membered ring(s), and 2 ether(s) (aliphatic). Images of the chemical structure of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane are given below:

The 2D chemical structure image of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane 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 Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane 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 Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane. Download structure data file (SDF/MOL) file of this compound.

---

Search Another Chemical Structure

Enter another compound to search for chemical structure:

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 Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane Molecule

• SMILES (Simplified Molecular-Input Line-Entry System) string of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane

  The SMILES string of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane is CC(C)C1COC(=N1)CC2=NC(CO2)C(C)C, which can be can be imported by most molecule editors for conversion back into two-dimensional drawings or three-dimensional models of the Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane.

• Structure Data File (SDF/MOL File) of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane

  The structure data file (SDF/MOL File) of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane is available for download in the SDF page of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane, which provides the information about the atoms, bonds, connectivity and coordinates of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane. The Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane structure data file can be imported to most of the cheminformatics software systems and applications.

• Chemical formula of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane

  The molecular formula of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane is available in chemical formula page of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• Molecular weight of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane

  The molecular weight of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane is available in molecular weight page of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane, 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 Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane

  The Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane including the various registry numbers, if available:

  • (4S,4'S)-2,2'-Methylenebis[4-(propan-2-yl)-4,5-dihydro-1,3-oxazole]
  • I14-8987
  • 2,2'-Methylenebis(4beta-isopropyl-2-oxazoline)
  • K-4130
  • bis[(4s)-(l-methyiethyl)oxazolin-2-yl]methane
  • MFCD11558948
  • ANW-65127
  • 5900AA
  • Oxazole,2,2'-methylenebis[4,5-dihydro-4-(1-methylethyl)-, (4S,4'S)-
  • C13H22N2O2

  • BIS[(4S)-(1-METHYLETHYL)OXAZOLIN-2-YL]METHANE
  • Bis[(S)-4-isopropyl-4,5-dihydrooxazol-2-yl]methane
  • Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane
  • Bis[ - oxazolin-2-yl]methane
  • 131833-90-4

---

Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane?
C13H22N2O2
How many atoms and what are the elements included the Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane molecule?
39 atom(s) - 22 Hydrogen atom(s), 13 Carbon atom(s), 2 Nitrogen atom(s), and 2 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane structure?
40 bond(s) - 18 non-H bond(s), 2 multiple bond(s), 4 rotatable bond(s), 2 double bond(s), 2 five-membered ring(s), and 2 ether(s) (aliphatic)
What’s the Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane’s molecular weight?
238.32598 g/mol
What’s the SMILES code of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane?
CC(C)C1COC(=N1)CC2=NC(CO2)C(C)C
What’s the InChI string of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane?
InChI=1S/C13H22N2O2/c1-8(2)10-6-16-12(14-10)5-13-15-11(7-17-13)9(3)4/h8-11H,5-7H2,1-4H3/t10-,11-/m1/s1
What’s the InChIKey code of Bis((S)-4-Isopropyl-4,5-dihydrooxazol-2-yl)methane?
KEHOIBBPRFRZFW-GHMZBOCLSA-N

41 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).