Cas no 956904-18-0 (1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 5-hydroxy-, ethyl ester)
956904-18-0 structure
Product Name:1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 5-hydroxy-, ethyl ester
CAS No:956904-18-0
MF:C10H10N2O3
MW:206.198002338409
CID:835298
PubChem ID:73013605
Update Time:2025-04-19
1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 5-hydroxy-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- 1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 5-hydroxy-, ethyl ester
- 5-HYDROXY-1H-PYRROLO[2,3-B]PYRIDINE-2-CARBOXYLIC ACID ETHYL ESTER
- Ethyl 5-hydroxy-1H-pyrrolo[2,3-b]pyridine-2-carboxylate
- 956904-18-0
- 1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid,5-hydroxy-,ethyl ester
- SCHEMBL24201478
-
- Inchi: 1S/C10H10N2O3/c1-2-15-10(14)8-4-6-3-7(13)5-11-9(6)12-8/h3-5,13H,2H2,1H3,(H,11,12)
- InChI Key: WSKMYOXZQQPEAQ-UHFFFAOYSA-N
- SMILES: O(CC)C(C1=CC2=CC(=CN=C2N1)O)=O
Computed Properties
- Exact Mass: 206.06914219g/mol
- Monoisotopic Mass: 206.06914219g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 15
- Rotatable Bond Count: 3
- Complexity: 247
- 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: 1.5
- Topological Polar Surface Area: 75.2?2
1H-Pyrrolo[2,3-b]pyridine-2-carboxylic acid, 5-hydroxy-, ethyl ester Related Literature
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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