Cas no 672293-18-4 (1H-Indole-5-carboxylicacid,6-ethoxy-(9CI))
672293-18-4 structure
Product Name:1H-Indole-5-carboxylicacid,6-ethoxy-(9CI)
CAS No:672293-18-4
MF:C11H11NO3
MW:205.209943056107
CID:1017522
PubChem ID:21100698
Update Time:2025-04-20
1H-Indole-5-carboxylicacid,6-ethoxy-(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole-5-carboxylicacid,6-ethoxy-(9CI)
- 6-Ethoxy-1H-Indole-5-Carboxylic Acid
- SCHEMBL4493257
- 672293-18-4
-
- Inchi： 1S/C11H11NO3/c1-2-15-10-6-9-7(3-4-12-9)5-8(10)11(13)14/h3-6,12H,2H2,1H3,(H,13,14)
- InChI Key： JTCBZWJMUSDBPO-UHFFFAOYSA-N
- SMILES： O(CC)C1C(C(=O)O)=CC2C=CNC=2C=1
Computed Properties
- Exact Mass: 205.07389321g/mol
- Monoisotopic Mass: 205.07389321g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 244
- 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: 62.3?2
1H-Indole-5-carboxylicacid,6-ethoxy-(9CI) Related Literature
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1. 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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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
672293-18-4 (1H-Indole-5-carboxylicacid,6-ethoxy-(9CI)) Related Products
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