8N0

2-bromanylpyridin-3-ol

Created:	2021-10-28
Last modified:	2022-08-22

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1 entries where 8N0 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	12
Chiral Atom Count	0
Bond Count	12
Aromatic Bond Count	6

2D diagram of 8N0

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Chemical Component Summary
Name	2-bromanylpyridin-3-ol
Systematic Name (OpenEye OEToolkits)	2-bromanylpyridin-3-ol
Formula	C₅ H₄ Br N O
Molecular Weight	173.995
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Oc1cccnc1Br
SMILES	OpenEye OEToolkits	2.0.7	c1cc(c(nc1)Br)O
Canonical SMILES	CACTVS	3.385	Oc1cccnc1Br
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cc(c(nc1)Br)O
InChI	InChI	1.06	InChI=1S/C5H4BrNO/c6-5-4(8)2-1-3-7-5/h1-3,8H
InChIKey	InChI	1.06	YKHQFTANTNMYPP-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	23070
CCDC/CSD	YELREN
COD	4508710

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.