Cas no 696648-05-2 (5-{(4-Methylbenzyl)thiomethyl}-2-furoic acid)

5-{(4-Methylbenzyl)thiomethyl}-2-furoic acid is a specialized organic compound featuring a furan ring core substituted with a thiomethyl and 4-methylbenzyl group, along with a carboxylic acid functionality. This structure imparts unique reactivity, making it valuable in synthetic chemistry, particularly in the development of heterocyclic compounds and pharmaceutical intermediates. The presence of both sulfur and aromatic moieties enhances its potential as a building block for bioactive molecules. Its well-defined molecular architecture allows for precise modifications, facilitating applications in medicinal chemistry and material science. The compound's stability and compatibility with various reaction conditions further underscore its utility in research and industrial settings.
5-{(4-Methylbenzyl)thiomethyl}-2-furoic acid structure
696648-05-2 structure
Product Name:5-{(4-Methylbenzyl)thiomethyl}-2-furoic acid
CAS No:696648-05-2
MF:C14H14O3S
MW:262.324162960052
MDL:MFCD03834532
CID:4716164
Update Time:2025-06-07

5-{(4-Methylbenzyl)thiomethyl}-2-furoic acid Chemical and Physical Properties

Names and Identifiers

    • 5-{[(4-methylbenzyl)thio]methyl}-2-furoic acid
    • 5-(((4-Methylbenzyl)thio)methyl)furan-2-carboxylic acid
    • 5-([(4-Methylbenzyl)thio]methyl)-2-furoic acid
    • MLS001202271
    • HMS2880H21
    • HMS1648J11
    • 5-[(4-methylphenyl)methylsulfanylmethyl]furan-2-carboxylic Acid
    • STK504361
    • SMR000565029
    • UNM000011085301
    • R7988
    • BB 0242429
    • 5-(
    • 5-{(4-Methylbenzyl)thiomethyl}-2-furoic acid
    • MDL： MFCD03834532
    • Inchi： 1S/C14H14O3S/c1-10-2-4-11(5-3-10)8-18-9-12-6-7-13(17-12)14(15)16/h2-7H,8-9H2,1H3,(H,15,16)
    • InChI Key： WYLCOKVKQDPXQZ-UHFFFAOYSA-N
    • SMILES： S(CC1=CC=C(C(=O)O)O1)CC1C=CC(C)=CC=1

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 5
  • Complexity: 274
  • Topological Polar Surface Area: 75.7

5-{(4-Methylbenzyl)thiomethyl}-2-furoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
M236505-250mg
5-{[(4-Methylbenzyl)thio]methyl}-2-furoic acid
 696648-05-2
250mg
 $ 275.00 2022-06-04
TRC
M236505-500mg
5-{[(4-Methylbenzyl)thio]methyl}-2-furoic acid
 696648-05-2
500mg
 $ 450.00 2022-06-04
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M236505-1000mg
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 $ 720.00 2022-06-04
Chemenu
CM524197-1g
5-(((4-Methylbenzyl)thio)methyl)furan-2-carboxylic acid
 696648-05-2 97%
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 $264 2024-07-24
abcr
AB406453-500 mg
5-{[(4-Methylbenzyl)thio]methyl}-2-furoic acid
 696648-05-2
500MG
 €254.60 2023-02-20
abcr
AB406453-1 g
5-{[(4-Methylbenzyl)thio]methyl}-2-furoic acid
 696648-05-2
1 g
 €322.50 2023-07-19
abcr
AB406453-5 g
5-{[(4-Methylbenzyl)thio]methyl}-2-furoic acid
 696648-05-2
5 g
 €907.00 2023-07-19
abcr
AB406453-500mg
5-{[(4-Methylbenzyl)thio]methyl}-2-furoic acid; .
 696648-05-2
500mg
 €269.00 2025-04-17
abcr
AB406453-1g
5-{[(4-Methylbenzyl)thio]methyl}-2-furoic acid; .
 696648-05-2
1g
 €317.00 2025-04-17
abcr
AB406453-5g
5-{[(4-Methylbenzyl)thio]methyl}-2-furoic acid; .
 696648-05-2
5g
 €877.00 2025-04-17

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