4-Nitrobenzenesulfonyl fluoride

• CAS: 349-96-2
• Catalog Number: ACM349962
• Category: Other Protecting Reagents
• Molecular Weight: 205.16
• Molecular Formula: C6H4FNO4S
• Melting Point: 78-80 °C (lit.)
• Hazard Statements: H314
• Physical State: Powder
• RIDADR: UN 3261 8 / PGII
• Symbol: GHS05

Custom Q&A

What is the molecular formula of 4-Nitrobenzenesulfonyl fluoride?

The molecular formula of 4-Nitrobenzenesulfonyl fluoride is C6H4FNO4S.

What is the molecular weight of 4-Nitrobenzenesulfonyl fluoride?

The molecular weight of 4-Nitrobenzenesulfonyl fluoride is 205.17 g/mol.

What is the IUPAC name of 4-Nitrobenzenesulfonyl fluoride?

The IUPAC name of 4-Nitrobenzenesulfonyl fluoride is 4-nitrobenzenesulfonyl fluoride.

What is the InChIKey of 4-Nitrobenzenesulfonyl fluoride?

The InChIKey of 4-Nitrobenzenesulfonyl fluoride is HRLAPUHJWRZEIC-UHFFFAOYSA-N.

What is the Canonical SMILES of 4-Nitrobenzenesulfonyl fluoride?

The Canonical SMILES of 4-Nitrobenzenesulfonyl fluoride is C1=CC(=CC=C1[N+](=O)[O-])S(=O)(=O)F.

What is the CAS number of 4-Nitrobenzenesulfonyl fluoride?

The CAS number of 4-Nitrobenzenesulfonyl fluoride is 349-96-2.

How many hydrogen bond donor counts does 4-Nitrobenzenesulfonyl fluoride have?

4-Nitrobenzenesulfonyl fluoride has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 4-Nitrobenzenesulfonyl fluoride have?

4-Nitrobenzenesulfonyl fluoride has 5 hydrogen bond acceptor counts.

What is the exact mass of 4-Nitrobenzenesulfonyl fluoride?

The exact mass of 4-Nitrobenzenesulfonyl fluoride is 204.98450694 g/mol.

Is 4-Nitrobenzenesulfonyl fluoride a canonicalized compound?

Yes, 4-Nitrobenzenesulfonyl fluoride is a canonicalized compound.

Synthetic Use

Upstream Synthesis Route 1

• 98-74-8

• 349-96-2

Reference: [1] Tetrahedron, 2016, vol. 72, # 1, p. 58 - 68

Upstream Synthesis Route 2

• 2937-05-5

• 349-96-2

Reference: [1] Patent: CN105198683, 2017, B, . Location in patent: Paragraph 0088; 0089; 0090

Upstream Synthesis Route 3

• 6325-93-5

• 349-96-2

Reference: [1]Journal of Organic Chemistry USSR (English Translation),1981,vol. 17,p. 1909 - 1914
Zhurnal Organicheskoi Khimii,1981,vol. 17,p. 2142 - 2147

Downstream Synthesis Route 1

• 349-96-2

• 73901-01-6

Reference: [1] Synlett, 2016, vol. 27, # 12, p. 1840 - 1843

Downstream Synthesis Route 2

• 349-96-2

• 98-62-4

Reference: [1]ACS Combinatorial Science,2018,vol. 20,p. 672 - 680
[2]Synlett,2016,vol. 27,p. 1840 - 1843
[3]Australian Journal of Chemistry,1953,vol. 6,p. 318
[4]Tetrahedron,2016,vol. 72,p. 58 - 68
[5]Patent: WO2015/188060,2015,A1 .Location in patent: Page/Page column 36; 37

Downstream Synthesis Route 3

• 349-96-2
• 1779-49-3

• 36195-98-9

Reference: [1]Recueil des Travaux Chimiques des Pays-Bas,1972,vol. 91,p. 37 - 49

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