Cas no 74420-08-9 (1H-Pyrrolo[2,3-b]pyridine,3-bromo-, 7-oxide)
74420-08-9 structure
Product Name:1H-Pyrrolo[2,3-b]pyridine,3-bromo-, 7-oxide
CAS No:74420-08-9
MF:C7H5BrN2O
MW:213.031400442123
CID:580990
PubChem ID:324216
Update Time:2025-04-19
1H-Pyrrolo[2,3-b]pyridine,3-bromo-, 7-oxide Chemical and Physical Properties
Names and Identifiers
-
- 1H-Pyrrolo[2,3-b]pyridine,3-bromo-, 7-oxide
- 3-bromo-7-hydroxypyrrolo[2,3-b]pyridine
- 3-Bromo-1H-pyrrolo[2,3-b]pyridine 7-oxide
- 3-Bromo-1H-pyrrolo< 2,3-b> pyridine 7-oxide
- AC1L8A4Z
- KB-65492
- NSC288719
- DTXSID70314808
- NSC-288719
- 74420-08-9
- 3-Bromo-7H-pyrrolo[2,3-b]pyridin-7-ol
- 1H-Pyrrolo[2,3-b]pyridine, 3-bromo-, 7-oxide
-
- Inchi: 1S/C7H5BrN2O/c8-6-4-9-7-5(6)2-1-3-10(7)11/h1-4,11H
- InChI Key: UTGIVWVFEOPOEY-UHFFFAOYSA-N
- SMILES: BrC1=CN=C2C1=CC=CN2O
Computed Properties
- Exact Mass: 211.95855
- Monoisotopic Mass: 211.959
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 155
- 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
- Topological Polar Surface Area: 38A^2
- XLogP3: 1.8
Experimental Properties
- Density: 1.87
- Boiling Point: 331.4°Cat760mmHg
- Flash Point: 154.2°C
- Refractive Index: 1.726
- PSA: 35.83
- LogP: 2.35890
1H-Pyrrolo[2,3-b]pyridine,3-bromo-, 7-oxide Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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