Cas no 847801-93-8 (1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 2-chloro-)
![1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 2-chloro- structure](https://ossimg.kuujia.com/scimg/848000/847801-93-8x500.png)
847801-93-8 structure
Product Name:1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 2-chloro-
CAS No:847801-93-8
MF:C8H5ClN2O
MW:180.59110045433
CID:835027
PubChem ID:46941713
Update Time:2025-04-19
1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 2-chloro- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 2-chloro-
- 2-Chloro-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde
- AKOS015899314
- 2-chloro-1H-pyrrolo[2,3-b]pyridine-3-carboxaldehyde
- 847801-93-8
- DTXSID901224325
- SCHEMBL2345339
- NUKYREQEVDCDRS-UHFFFAOYSA-N
-
- Inchi： 1S/C8H5ClN2O/c9-7-6(4-12)5-2-1-3-10-8(5)11-7/h1-4H,(H,10,11)
- InChI Key： NUKYREQEVDCDRS-UHFFFAOYSA-N
- SMILES： ClC1=C(C=O)C2=CC=CN=C2N1
Computed Properties
- Exact Mass: 180.0090405g/mol
- Monoisotopic Mass: 180.0090405g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 188
- 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: 1.7
- Topological Polar Surface Area: 45.8?2
1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 2-chloro- Related Literature
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
847801-93-8 (1H-Pyrrolo[2,3-b]pyridine-3-carboxaldehyde, 2-chloro-) Related Products
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