93E

3-chloranylpyridin-2-amine

Created:	2017-04-13
Last modified:	2017-07-12

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1 entries where 93E is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	13
Chiral Atom Count	0
Bond Count	13
Aromatic Bond Count	6

2D diagram of 93E

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Chemical Component Summary
Name	3-chloranylpyridin-2-amine
Systematic Name (OpenEye OEToolkits)	3-chloranylpyridin-2-amine
Formula	C₅ H₅ Cl N₂
Molecular Weight	128.56
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Nc1ncccc1Cl
SMILES	OpenEye OEToolkits	2.0.6	c1cc(c(nc1)N)Cl
Canonical SMILES	CACTVS	3.385	Nc1ncccc1Cl
Canonical SMILES	OpenEye OEToolkits	2.0.6	c1cc(c(nc1)N)Cl
InChI	InChI	1.03	InChI=1S/C5H5ClN2/c6-4-2-1-3-8-5(4)7/h1-3H,(H2,7,8)
InChIKey	InChI	1.03	RZJPBQGRCNJYBU-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	693267
CCDC/CSD	URAXER
COD	2230214

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.