Cas no 791073-79-5 (3,6-Methano-1H-pyrrolo[3,2-b]pyridine(9CI))
791073-79-5 structure
Product Name:3,6-Methano-1H-pyrrolo[3,2-b]pyridine(9CI)
CAS No:791073-79-5
MF:C8H6N2
MW:130.146641254425
CID:555479
PubChem ID:45092505
Update Time:2025-04-19
3,6-Methano-1H-pyrrolo[3,2-b]pyridine(9CI) Chemical and Physical Properties
Names and Identifiers
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- 3,6-Methano-1H-pyrrolo[3,2-b]pyridine(9CI)
- AG-H-17258
- 3,6-METHANO-1H-PYRROLO[3,2-B]PYRIDINE
- CTK2H6279
- KB-179953
- 1H-3,6-Methanopyrrolo[3,2-b]pyridine
- DTXSID00666983
- 791073-79-5
-
- Inchi: 1S/C8H6N2/c1-5-2-7-8(10-3-5)6(1)4-9-7/h2-4,9H,1H2
- InChI Key: BWEVGBYACZENCW-UHFFFAOYSA-N
- SMILES: N1C=C2C3=C1C=C(C=N3)C2
Computed Properties
- Exact Mass: 130.05300
- Monoisotopic Mass: 130.053098200g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 157
- 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: 1.1
- Topological Polar Surface Area: 28.7?2
Experimental Properties
- PSA: 28.68000
- LogP: 1.46710
3,6-Methano-1H-pyrrolo[3,2-b]pyridine(9CI) Related Literature
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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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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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Pavel Karásek,Jakub Grym,Michal Roth,Josef Planeta,Franti?ek Foret Lab Chip, 2015,15, 311-318
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