4-Chloropyridazin-3(2H)-one - CAS 1677-79-8

Catalog:	BB012420
Product Name:	4-Chloropyridazin-3(2H)-one
CAS:	1677-79-8
Synonyms:	5-chloro-1H-pyridazin-6-one; 5-chloro-1H-pyridazin-6-one

Technical Data

Patents

Computed Properties

IUPAC Name:	5-chloro-1H-pyridazin-6-one
Description:	4-Chloropyridazin-3(2H)-one (CAS# 1677-79-8) is a useful research chemical.
Molecular Weight:	130.53
Molecular Formula:	C4H3ClN2O
Canonical SMILES:	C1=C(C(=O)NN=C1)Cl
InChI:	InChI=1S/C4H3ClN2O/c5-3-1-2-6-7-4(3)8/h1-2H,(H,7,8)
InChI Key:	UYWAYTBDMJFIQT-UHFFFAOYSA-N
LogP:	0.42330

Publication Number	Title	Priority Date
WO-2021123145-A1	Sigma-1 receptor ligands and uses thereof	20191219
WO-2021123174-A1	Sigma-1 receptor ligands and therapeutic uses thereof	20191219
JP-2021088796-A	Transfer printing method and transfer printing equipment	20191206
US-2021198239-A1	Compounds and methods for cd73 modulation and indications therefor	20191206
WO-2021113625-A1	Compounds and methods for cd73 modulation and indications therefor	20191206

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Related Functional Groups

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Complexity:	173
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	129.9933904
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	129.9933904
Rotatable Bond Count:	0
Topological Polar Surface Area:	41.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1