Cas no 89032-83-7 (1,2,5-Thiadiazole-3-carboxylicacid, 4-methoxy-)
89032-83-7 structure
Product Name:1,2,5-Thiadiazole-3-carboxylicacid, 4-methoxy-
CAS No:89032-83-7
MF:C4H4N2O3S
MW:160.151159286499
CID:710845
PubChem ID:24860327
Update Time:2025-04-19
1,2,5-Thiadiazole-3-carboxylicacid, 4-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- 1,2,5-Thiadiazole-3-carboxylicacid, 4-methoxy-
- 1,2,5-Thiadiazole-3-carboxylicacid,4-methoxy-(7CI,9CI)
- BDBM23253
- 89032-83-7
- 4-methoxy-1,2,5-thiadiazole-3-carboxylic acid
- DTXSID50647742
- 1,2,5-Thiadiazole, TDA3
-
- Inchi： 1S/C4H4N2O3S/c1-9-3-2(4(7)8)5-10-6-3/h1H3,(H,7,8)
- InChI Key： BIGFTKUERGTAPT-UHFFFAOYSA-N
- SMILES： S1N=C(C(C(=O)O)=N1)OC
Computed Properties
- Exact Mass: 159.99426317g/mol
- Monoisotopic Mass: 159.99426317g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 143
- 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: 0.5
- Topological Polar Surface Area: 101?2
1,2,5-Thiadiazole-3-carboxylicacid, 4-methoxy- Related Literature
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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