Cas no 103918-73-6 (2-Phenylthio-5-propionylphenylacetic acid)

2-Phenylthio-5-propionylphenylacetic acid is a specialized organic compound featuring a phenylthio group and a propionylphenylacetic acid backbone. Its unique structure makes it valuable in synthetic chemistry, particularly as an intermediate in the preparation of pharmaceuticals and fine chemicals. The presence of both thioether and carboxylic acid functionalities allows for versatile reactivity, enabling selective modifications for targeted applications. This compound exhibits stability under standard conditions, facilitating handling and storage. Its well-defined molecular architecture ensures consistent performance in reactions such as coupling or functional group transformations. Researchers may find it useful in developing bioactive molecules or studying structure-activity relationships due to its balanced lipophilicity and reactivity profile.
2-Phenylthio-5-propionylphenylacetic acid structure
103918-73-6 structure
Product Name:2-Phenylthio-5-propionylphenylacetic acid
CAS No:103918-73-6
MF:C17H16O3S
MW:300.372143745422
CID:62430
PubChem ID:13650250
Update Time:2025-10-29

2-Phenylthio-5-propionylphenylacetic acid Chemical and Physical Properties

Names and Identifiers

    • 2-Phenylthio-5-propionylphenylacetic acid
    • 2-(2-phenylsulfanyl-5-propanoylphenyl)acetic acid
    • 5-(1-oxopropyl)-2-(phenylthio)Benzeneaceticacid
    • 5-PROPIONYL-2-THIOPHENYL-PHENYL ACETIC ACID OR METHYL ESTER (PPP)
    • 2-(2-(Phenylthio)-5-propionylphenyl)acetic acid
    • Benzeneacetic acid,5-(1-oxopropyl)-2-(phenylthio)
    • 5-(1-oxopropyl)-2-(phenylthio)-Benzeneacetic acid,
    • 5-PROPIONYL-2-THIOPHENYL-PHENYL ACETICACID
    • METHYL ESTER
    • A896338
    • 5-propionyl-2-phenylthiophenylacetic acid
    • 103918-73-6
    • SCHEMBL9630775
    • DTXSID00545840
    • OIDXFJQJYOGXHS-UHFFFAOYSA-N
    • [2-(PHENYLSULFANYL)-5-PROPANOYLPHENYL]ACETIC ACID
    • 2-Phenylthio-5-propionylphenyl acetic acid
    • AKOS015913864
    • 2-(2-(phenylthio)-5-propionylphenyl)aceticacid
    • 5-PROPIONYL-2-THIOPHENYL-PHENYL ACETICACID/METHYL ESTER
    • 5-(1-Oxopropyl)-2-(phenylthio)benzeneacetic Acid
    • Inchi: 1S/C17H16O3S/c1-2-15(18)12-8-9-16(13(10-12)11-17(19)20)21-14-6-4-3-5-7-14/h3-10H,2,11H2,1H3,(H,19,20)
    • InChI Key: OIDXFJQJYOGXHS-UHFFFAOYSA-N
    • SMILES: S(C1C=CC=CC=1)C1C=CC(C(CC)=O)=CC=1CC(=O)O

Computed Properties

  • Exact Mass: 300.08200
  • Monoisotopic Mass: 300.08201554g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 6
  • Complexity: 363
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3.6
  • Topological Polar Surface Area: 79.7?2

Experimental Properties

  • PSA: 79.67000
  • LogP: 4.05760

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2-Phenylthio-5-propionylphenylacetic acid Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:103918-73-6)2-Phenylthio-5-propionylphenylacetic acid
Order Number:A896338
Stock Status:in Stock
Quantity:25g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 11:55
Price ($):237.0
Recommended suppliers
Amadis Chemical Company Limited
(CAS:103918-73-6)2-Phenylthio-5-propionylphenylacetic acid
A896338
Purity:99%
Quantity:25g
Price ($):237.0
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