Aminomalononitrile p-toluenesulfonate

• CAS: 5098-14-6
• Catalog Number: ACM5098146
• Category: Other Products
• Molecular Weight: 253.28
• Molecular Formula: C₁₀H₁₁N₃O₃S
• Synonyms: DICYANOMETHYLAMMONIUM P-TOLUENESULFONATE;2-AMINOMALONONITRILE-4-METHYLBENZENESULFONATE;AMINOMALONONITRILE 4-TOLUENESULFONATE;AMINOMALONONITRILE P-TOLUENESULFONATE;AMINOMALONONITRILE P-TOLUENESULFONIC ACID;AMINOMALONONITRILE P-TOLUENESULFUNIC ACID;AMINOMALONONITRILE P-TOLUENESULPHONATE;AMINOMALONONITRILE TOSYLATE
• Melting Point: 174°C (dec.)(lit.)
• Hazard Statements: Xn
• Safety Description: 36
• Supplemental Hazard Statements: H302+H312+H332-H301+H311+H331-H315-H319-H302-H312-H331-H335
• Symbol: GHS06,GHS07

Custom Q&A

What is the PubChem CID for Aminomalononitrile p-toluenesulfonate?

The PubChem CID for Aminomalononitrile p-toluenesulfonate is 563049.

What is the molecular formula of Aminomalononitrile p-toluenesulfonate?

The molecular formula of Aminomalononitrile p-toluenesulfonate is C10H11N3O3S.

What are some synonyms of Aminomalononitrile p-toluenesulfonate?

Some synonyms of Aminomalononitrile p-toluenesulfonate are 5098-14-6, 2-Aminomalononitrile 4-methylbenzenesulfonate, Aminomalononitrile p-toluenesulphonate, and 2-Aminomalononitrile 4-methylbenzenesulphonate.

What is the molecular weight of Aminomalononitrile p-toluenesulfonate?

The molecular weight of Aminomalononitrile p-toluenesulfonate is 253.28 g/mol.

What is the IUPAC name of Aminomalononitrile p-toluenesulfonate?

The IUPAC name of Aminomalononitrile p-toluenesulfonate is 2-aminopropanedinitrile;4-methylbenzenesulfonic acid.

What is the InChI of Aminomalononitrile p-toluenesulfonate?

The InChI of Aminomalononitrile p-toluenesulfonate is: InChI=1S/C7H8O3S.C3H3N3/c1-6-2-4-7(5-3-6)11(8,9)10;4-1-3(6)2-5/h2-5H,1H3,(H,8,9,10);3H,6H2.

What is the InChIKey of Aminomalononitrile p-toluenesulfonate?

The InChIKey of Aminomalononitrile p-toluenesulfonate is MEUWQVWJLLBVQI-UHFFFAOYSA-N.

What is the canonical SMILES of Aminomalononitrile p-toluenesulfonate?

The canonical SMILES of Aminomalononitrile p-toluenesulfonate is CC1=CC=C(C=C1)S(=O)(=O)O.C(#N)C(C#N)N.

What is the CAS number of Aminomalononitrile p-toluenesulfonate?

The CAS number of Aminomalononitrile p-toluenesulfonate is 5098-14-6.

What is the European Community (EC) number of Aminomalononitrile p-toluenesulfonate?

The European Community (EC) number of Aminomalononitrile p-toluenesulfonate is 225-817-1.

Synthetic Use

Upstream Synthesis Route 1

• 36568-05-5
• 109-77-3

• 5098-14-6

Reference: [1] Patent: US4827015, 1989, A,

Upstream Synthesis Route 2

• 109-77-3

• 5098-14-6

Reference: [1] Tetrahedron Letters, 1982, vol. 23, # 37, p. 3835 - 3836

Downstream Synthesis Route 1

• 5098-14-6
• 75-36-5

• 5098-16-8

Reference: [1] Tetrahedron Letters, 1989, vol. 30, # 20, p. 2631 - 2632
[2] Asian Journal of Chemistry, 2013, vol. 25, # 9, p. 5079 - 5083

Downstream Synthesis Route 2

• 500-22-1
• 5098-14-6

• 131195-31-8
• 131195-39-6

Reference: [1]Journal of Organic Chemistry,1991,vol. 56,p. 657 - 663

Downstream Synthesis Route 3

• 498-62-4
• 67-56-1
• 5098-14-6

• 131195-32-9
• 131195-40-9

Reference: [1]Journal of Organic Chemistry,1991,vol. 56,p. 657 - 663

* For details of the synthesis route, please refer to the original source to ensure accuracy.