Structure

Phenol-4-sulfonic acid

CAS
98-67-9
Catalog Number
ACM98679
Category
Other Products
Molecular Weight
174.17
Molecular Formula
C6H6O4S

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What is the molecular formula of phenol-4-sulfonic acid?

The molecular formula of phenol-4-sulfonic acid is C6H6O4S.

What is the molecular weight of phenol-4-sulfonic acid?

The molecular weight of phenol-4-sulfonic acid is 174.18 g/mol.

What is the IUPAC name of phenol-4-sulfonic acid?

The IUPAC name of phenol-4-sulfonic acid is 4-hydroxybenzenesulfonic acid.

What is the InChI of phenol-4-sulfonic acid?

The InChI of phenol-4-sulfonic acid is InChI=1S/C6H6O4S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4,7H,(H,8,9,10).

What is the InChIKey of phenol-4-sulfonic acid?

The InChIKey of phenol-4-sulfonic acid is FEPBITJSIHRMRT-UHFFFAOYSA-N.

What is the canonical SMILES of phenol-4-sulfonic acid?

The canonical SMILES of phenol-4-sulfonic acid is C1=CC(=CC=C1O)S(=O)(=O)O.

What is the CAS number of phenol-4-sulfonic acid?

The CAS number of phenol-4-sulfonic acid is 98-67-9.

What is the EC number of phenol-4-sulfonic acid?

The EC number of phenol-4-sulfonic acid is 202-691-6.

What is the UNII of phenol-4-sulfonic acid?

The UNII of phenol-4-sulfonic acid is L74LRO149A.

Downstream Synthesis Route 1

  • 98-67-9
  • 1698-60-8

Reference: [1] Patent: US4454318, 1984, A,

Downstream Synthesis Route 2

  • 98-67-9
  • 87001-32-9

Reference: [1] Bioorganic and Medicinal Chemistry, 2002, vol. 10, # 11, p. 3649 - 3661

Downstream Synthesis Route 3

  • 98-67-9
  • 108-95-2
  • 80-09-1

Reference: [1] Zhurnal Obshchei Khimii, 1958, vol. 28, p. 1274; engl. Ausg. S. 1330

Downstream Synthesis Route 4

  • 98-67-9
  • 611-62-1

Reference: [1]Lincke
[Journal fur praktische Chemie (Leipzig 1954), 1873, vol. <2> 8, p. 44]

Downstream Synthesis Route 5

  • 98-67-9
  • 88-06-2

Reference: [1]Datta; Mitter
[Journal of the American Chemical Society, 1919, vol. 41, p. 2034]

Downstream Synthesis Route 6

  • 98-67-9
  • 118-79-6

Reference: [1]Datta; Bhoumik
[Journal of the American Chemical Society, 1921, vol. 43, p. 311]

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

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