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Ethyl 6-Chloro-1H-pyrrolo[2,3-b]pyridine-1-carboxylate

Ethyl 6-Chloro-1H-pyrrolo[2,3-b]pyridine-1-carboxylate - CAS 849068-50-4

Catalog:	BB037367
Product Name:	Ethyl 6-Chloro-1H-pyrrolo[2,3-b]pyridine-1-carboxylate
CAS:	849068-50-4
Synonyms:	6-chloro-1-pyrrolo[2,3-b]pyridinecarboxylic acid ethyl ester; ethyl 6-chloropyrrolo[2,3-b]pyridine-1-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl 6-chloropyrrolo[2,3-b]pyridine-1-carboxylate
Description:	Ethyl 6-Chloro-1H-pyrrolo[2,3-b]pyridine-1-carboxylate (CAS# 849068-50-4) is a useful research chemical.
Molecular Weight:	224.64
Molecular Formula:	C10H9ClN2O2
Canonical SMILES:	CCOC(=O)N1C=CC2=C1N=C(C=C2)Cl
InChI:	InChI=1S/C10H9ClN2O2/c1-2-15-10(14)13-6-5-7-3-4-8(11)12-9(7)13/h3-6H,2H2,1H3
InChI Key:	WWOGRMWUPOAZIT-UHFFFAOYSA-N
LogP:	2.69430

Publication Number	Title	Priority Date
US-2019211011-A1	Compounds for using in imaging and particularly for the diagnosis of neurodegenerative diseases	20160926
EP-3515912-B1	Compounds for using in imaging and particularly for the diagnosis of neurodegenerative diseases	20160926
US-10906900-B2	Compounds for using in imaging and particularly for the diagnosis of neurodegenerative diseases	20160926
WO-2016112088-A1	Aryloxyacetylindoles and analogs as antibiotic tolerance inhibitors	20150106
EP-2548876-A1	New CRTh2 antagonists	20110718

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Complexity:	250
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	224.0352552
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	224.0352552
Rotatable Bond Count:	2
Topological Polar Surface Area:	44.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9