Cas no 3996-32-5 ((3-Methoxy-phenylsulfanyl)acetic Acid)
(3-Methoxy-phenylsulfanyl)acetic Acid is a sulfur-containing aromatic compound featuring a methoxy-substituted phenyl ring linked to an acetic acid moiety via a thioether bridge. This structure imparts unique reactivity, making it valuable as an intermediate in organic synthesis, particularly for constructing biologically active molecules or functional materials. The methoxy group enhances solubility in organic solvents, while the thioether linkage offers potential for further derivatization. Its acetic acid functionality allows for easy conjugation or salt formation, improving compatibility in various reaction conditions. The compound is typically used in pharmaceutical research, agrochemical development, and specialty chemical applications where tailored aromatic-thioether architectures are required. Proper handling is advised due to potential sensitivity to oxidation.
3996-32-5 structure
Product Name:(3-Methoxy-phenylsulfanyl)acetic Acid
CAS No:3996-32-5
MF:C9H10O3S
MW:198.238901615143
CID:1514906
PubChem ID:820084
Update Time:2025-05-28
(3-Methoxy-phenylsulfanyl)acetic Acid Chemical and Physical Properties
Names and Identifiers
-
- [(3-methoxyphenyl)sulfanyl]acetic acid
- [(3-methoxyphenyl)thio]acetic acid
- Acetic acid, 2-[(3-methoxyphenyl)thio]-
- 2-(3-methoxyphenyl)sulfanylacetic acid
- 3-Methoxy-phenylthioacetic acid
- 2-((3-Methoxyphenyl)thio)acetic acid
- 3996-32-5
- AN-967/25120027
- AKOS000141218
- Z239812082
- acetic acid, 2-(3-methoxyphenyl)thio-
- 2-[(3-methoxyphenyl)sulfanyl]acetic acid
- BS-37807
- EN300-43625
- DTXSID00356155
- SCHEMBL10222071
- 3-Methoxy-phenylthioaceticacid
- 3-Methoxyphenylthioacetic acid
- AM100771
- DB-289888
- (3-Methoxy-phenylsulfanyl)-acetic acid
- MFCD03426971
- 2-((3-Methoxyphenyl)thio)aceticacid
- E84000
- LMSQEBMMWJHLQK-UHFFFAOYSA-N
- (3-Methoxy-phenylsulfanyl)acetic Acid
-
- MDL： MFCD03426971
- Inchi： 1S/C9H10O3S/c1-12-7-3-2-4-8(5-7)13-6-9(10)11/h2-5H,6H2,1H3,(H,10,11)
- InChI Key： LMSQEBMMWJHLQK-UHFFFAOYSA-N
- SMILES： S(CC(=O)O)C1C=CC=C(C=1)OC
Computed Properties
- Exact Mass: 198.0351
- Monoisotopic Mass: 198.03506535g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 172
- 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: 1.9
- Topological Polar Surface Area: 71.8?2
Experimental Properties
- PSA: 46.53
(3-Methoxy-phenylsulfanyl)acetic Acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Fluorochem | 033390-1g |
3-Methoxy-phenylthioacetic acid |
3996-32-5 | 95% | 1g |
￡88.00 | 2022-03-01 | |
| Fluorochem | 033390-5g |
3-Methoxy-phenylthioacetic acid |
3996-32-5 | 95% | 5g |
￡257.00 | 2022-03-01 | |
| TRC | M350223-50mg |
(3-Methoxy-phenylsulfanyl)acetic Acid |
3996-32-5 | 50mg |
$ 50.00 | 2022-06-03 | ||
| TRC | M350223-100mg |
(3-Methoxy-phenylsulfanyl)acetic Acid |
3996-32-5 | 100mg |
$ 65.00 | 2022-06-03 | ||
| TRC | M350223-500mg |
(3-Methoxy-phenylsulfanyl)acetic Acid |
3996-32-5 | 500mg |
$ 115.00 | 2022-06-03 | ||
| eNovation Chemicals LLC | Y1248811-100mg |
3-Methoxy-phenylthioaceticacid |
3996-32-5 | 95% | 100mg |
$65 | 2024-06-06 | |
| eNovation Chemicals LLC | Y1248811-250mg |
3-Methoxy-phenylthioaceticacid |
3996-32-5 | 95% | 250mg |
$75 | 2024-06-06 | |
| eNovation Chemicals LLC | Y1248811-1g |
3-Methoxy-phenylthioaceticacid |
3996-32-5 | 95% | 1g |
$120 | 2024-06-06 | |
| eNovation Chemicals LLC | Y1248811-10g |
3-Methoxy-phenylthioaceticacid |
3996-32-5 | 95% | 10g |
$415 | 2024-06-06 | |
| eNovation Chemicals LLC | Y1248811-250mg |
3-Methoxy-phenylthioaceticacid |
3996-32-5 | 95% | 250mg |
$75 | 2025-02-19 |
(3-Methoxy-phenylsulfanyl)acetic Acid Related Literature
-
Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
-
Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
-
4. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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