Structure

Silver p-toluenesulfonate

CAS
16836-95-6
Catalog Number
ACM16836956
Category
Metal & Ceramic Materials
Molecular Weight
279.06
Molecular Formula
C7H7AgO3S;

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Specification

Synonyms
P-Toluenesulfonic acid silver salt
IUPAC Name
Silver;4-methylbenzenesulfonate
SMILES
CC1=CC=C(C=C1)S(=O)(=O)[O-].[Ag+]
InChI
InChI=1S/C7H8O3S.Ag/c1-6-2-4-7(5-3-6)11(8,9)10;/h2-5H,1H3,(H,8,9,10);/q;+1/p-1
InChI Key
JUDUFOKGIZUSFP-UHFFFAOYSA-M
Melting Point
264-266 °C
Solubility
Soluble in water
Appearance
Powder
Storage
Store below +30 °C
Complexity
193
Covalently-Bonded Unit Count
2
EC Number
240-859-0
Exact Mass
277.91668
H-Bond Acceptor
3
Heavy Atom Count
12
Monoisotopic Mass
277.91668
Topological Polar Surface Area
65.6 Ų
April 6, 2023


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What is the PubChem CID of Silver p-toluenesulfonate?

PubChem CID: 85606

What is the molecular formula of Silver p-toluenesulfonate?

Molecular Formula: C7H7AgO3S

What is the molecular weight of Silver p-toluenesulfonate?

Molecular Weight: 279.06 g/mol

What is the IUPAC name of Silver p-toluenesulfonate?

IUPAC Name: silver;4-methylbenzenesulfonate

What is the InChI of Silver p-toluenesulfonate?

InChI: InChI=1S/C7H8O3S.Ag/c1-6-2-4-7(5-3-6)11(8,9)10;/h2-5H,1H3,(H,8,9,10);/q;+1/p-1

What is the InChIKey of Silver p-toluenesulfonate?

InChIKey: JUDUFOKGIZUSFP-UHFFFAOYSA-M

What is the canonical SMILES of Silver p-toluenesulfonate?

Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)[O-].[Ag+]

What is the CAS number of Silver p-toluenesulfonate?

CAS number: 16836-95-6

What is the related CAS number of Silver p-toluenesulfonate?

Related CAS number: 104-15-4 (Parent)

Is Silver p-toluenesulfonate a canonicalized compound?

Yes, it is canonicalized.

Downstream Synthesis Route 1

  • 16836-95-6
  • 98-59-9
  • 4124-41-8

Reference: [1] Bulletin of the Academy of Sciences of the USSR, Division of Chemical Science (English Translation), 1981, vol. 30, # 9, p. 1712 - 1714[2] Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1981, vol. 30, # 9, p. 2087 - 2090

Downstream Synthesis Route 2

  • 16836-95-6
  • 4124-41-8

Reference: [1] Journal of Organic Chemistry, 1977, vol. 42, p. 2910 - 2913

Downstream Synthesis Route 3

  • 16836-95-6
  • 106-93-4
  • 6315-52-2

Reference: [1] Journal of the American Chemical Society, 1953, vol. 75, p. 2257

Downstream Synthesis Route 4

  • 75-11-6
  • 16836-95-6
  • 24124-59-2

Reference: [1]ChemMedChem,2014,vol. 9,p. 1476 - 1487

Downstream Synthesis Route 5

  • 6940-49-4
  • 16836-95-6
  • 82027-09-6

Reference: [1]Journal of Organic Chemistry,1982,vol. 47,p. 3171 - 3172

Downstream Synthesis Route 6

  • 16836-95-6
  • 81221-80-9
  • 101981-07-1

Reference: [1]Journal of Organic Chemistry,1986,vol. 51,p. 2472 - 2480

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

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