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Drawing Chemical Structures with Chemsketch

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0% found this document useful (0 votes)
62 views6 pages

Drawing Chemical Structures with Chemsketch

Copyright
© All Rights Reserved
We take content rights seriously. If you suspect this is your content, claim it here.
Available Formats
Download as DOCX, PDF, TXT or read online on Scribd

Experiment – 10

DRAW CHEMICAL STRUCTURES USING


CHEMDRAW/CHEMSKETCH SOFTWARE
Name: Date: XX/XX/202X
SRN:
PRN:

Part 1 : Draw the following molecules using


CHEMSKETCH
1. Eriochrome Black-T (EBT)

2. Disodium salt of ethylene diamine tetra acetic acid (Na2EDTA)


O
HO O
N O-Na+
Na+O- N
O OH
O

3. Ferroin

N
+2 +3
Fe /Fe

3
4. Starch (Amylose)

OH
OH OH

H OH
H OH H OH
H
OH H H H
O OH H OH H
HO O
OH
H OH
H OH H OH
n
5. Polyvinyl alcohol (PVA)
OH

H3C

CH3
n

6. p-Nitrobenzoyl chloride

O O-
+
N

Cl O

7. 2,6,8-Trichloro-purine
Cl

NH
N
Cl

Cl N N

8. 3-Bromo-4-methoxybiphenyl

Br
O
CH3
9. 4-Hydroxyazobenzene

N
N OH

10. (2S)-2-Amino-3-(1H-indol-3-yl) propanoic acid (Tryptophan)

11. 2,5-Piperazinedione

12. 9,10-Phenanthrenedione
13. β-N-Acetyl-D-glucosamine
O OH
HO O

HO NH CH3
OH

14. 1,4-Benzenediamine, N-(4-methoxyphenyl) monohydrochloride


(Variamine Blue B)

Part 2: Draw the chemical structures involved in the


synthesis of Carbon fiber,with
Polyacrylonitrile(PAN) as precursor,using
CHEMSKETCH
1. Acrylonitrile (Precursor)

2. Polyacrylonitrile(PAN)-(Intermediate)

3. Initial Heat treatment (Cyclisation) Intermediate :


4. Second Heat treatment Intermediate (Oxidative) at 700 ° C :

5. Tertiary Heat treatment (Oxidative) at 400 - 600 ° C :

6. Final Heat treatment Product at 600-1300 ° C :


[Link] Carbon Fibre structure after Graphitisation at 2000 ° C:

Tube structure

Flat structure

Common questions

Powered by AI

Software like ChemDraw and ChemSketch allows for precise and detailed illustration of complex chemical structures, which aids in understanding the molecular makeup and interactions in educational experiments. These tools provide a systematic approach to visualize chemical entities such as Eriochrome Black-T, Na2EDTA, and other structures listed in the experiment. By facilitating accurate representations, these programs enhance comprehension and retention of complex chemistry concepts, making them invaluable in educational settings.

Tryptophan's structure is distinguished by its indole ring attached to the amino acid backbone, consisting of an amino group, a carboxyl group, and a side chain with an indole moiety. The indole ring confers hydrophobic properties and influences protein folding, while the primary amine and carboxylic acid groups allow for peptide bond formation. As an essential amino acid, tryptophan is critical for protein synthesis, serotonin production, and as a precursor for the biosynthesis of niacin (vitamin B3). These structural features illustrate its importance in maintaining physiological processes.

The structure of p-Nitrobenzoyl chloride includes a benzene ring with an electron-withdrawing nitro group and a reactive acyl chloride. The presence of the nitro group increases the electrophilicity of the acyl chloride, facilitating nucleophilic substitution reactions. This heightened reactivity makes it an effective acylating agent in organic synthesis, enabling the introduction of acyl groups into various molecules through reactions like Friedel-Crafts acylation, producing ketones and other derivatives often used in pharmaceuticals and dyes.

To effectively use CHEMSKETCH for drawing complex structures like Polyacrylonitrile, a user must grasp organic chemistry fundamentals and molecular geometry concepts. Understanding bond types, electron pair orientation, and functional group behavior is essential. Proficiency in navigating software features, such as selecting atoms, designing polymer chains, and employing tools for stereochemistry, ensures accurate representation of PAN’s linear polymer structure. This requires an integration of chemical knowledge with technical software skills.

Eriochrome Black-T and 3-Bromo-4-methoxybiphenyl differ significantly in their structures: Eriochrome Black-T contains multiple aromatic rings and functional groups like OH and sulfonic acid groups, which increase its solubility in water and ability to bind metal ions. In contrast, 3-Bromo-4-methoxybiphenyl has a biphenyl structure with a bromine atom and a methoxy group, resulting in nonpolar characteristics with specific reactivity due to the bromine's electronegativity. These structural differences lead to Eriochrome Black-T’s application as a complexometric indicator, while 3-Bromo-4-methoxybiphenyl is used in different organic synthesis contexts.

The synthesis of carbon fiber using polyacrylonitrile (PAN) requires a sequence of heat treatments to achieve desired structural transformations. Initial cyclisation stabilizes PAN through infusible ladder polymer formation. Subsequent oxidative heat treatments at specified temperatures induce cyclization and dehydrogenation, setting the carbon structure necessary for high-temperature resistance. Finally, graphitization at elevated temperatures aligns the carbon atoms into graphite planes. Each stage is crucial for converting PAN into a strong, thermally stable carbon fiber, demonstrating how controlled thermal processes shape the material's properties.

Polyvinyl alcohol (PVA) is characterized by its repeating hydroxyl groups, making it highly soluble in water and suitable for forming films or fibers. Its structure allows for excellent adhesive properties and film-forming capabilities, lending itself to applications in textile sizing, paper coating, and as a component in artificial tears and medical products. The hydroxyl groups also engage in hydrogen bonding, enhancing its utility in emulsification and stabilization processes in several industries.

β-N-Acetyl-D-glucosamine possesses an acetamido group at the C2 position and a pyranose ring, which facilitate hydrogen bonding and contribute to strong intermolecular forces. This provides rigidity and strength when forming polymers such as chitin. The acetamido group's ability to engage in hydrogen bonds stabilizes cellular walls and contributes to the overall structural integrity of tissues in organisms like arthropods and fungi. These features make it a critical building block in cellular matrixes.

The molecular structures in Part 2 align with carbon fiber production stages by changing forms reflective of each heat treatment phase. Acrylonitrile monomers polymerize to form Polyacrylonitrile (PAN), which undergoes stabilization through cyclisation, where the nitrile groups form cyclic structures to prevent melting. Further oxidation leads to ladder polymer formation, where cross-linking enhances stability. High-temperature graphitization reorganizes carbon atoms into crystalline structures, producing strong, durable carbon fibers. Each molecular transformation reflects the specific chemical reactions facilitated by the corresponding heat treatment, aligning structural changes with material properties.

The structural complexity of 1,4-Benzenediamine, N-(4-methoxyphenyl) monohydrochloride arises from its combination of amino groups and an aromatic ring substituted with a methoxy group. These features, along with an ionic monohydrochloride form, contribute to both its chemical activity and stability. The electron-donating methoxy group affects the distribution of electron density, possibly enhancing reactivity toward electrophiles. However, the hydrochloride form enhances solubility and stability in aqueous solutions. These properties expand its applications in dyes and pigments, where such stability and reactivity adjustments are crucial.

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