5-Chloro-3-pyridinemethanol - CAS 22620-34-4

Catalog:	BB017687
Product Name:	5-Chloro-3-pyridinemethanol
CAS:	22620-34-4
Synonyms:	(5-chloro-3-pyridinyl)methanol; (5-chloropyridin-3-yl)methanol

Technical Data

Patents

Computed Properties

IUPAC Name:	(5-chloropyridin-3-yl)methanol
Description:	5-Chloro-3-pyridinemethanol (CAS# 22620-34-4) is used in preparation of piperidines or piperidones substituted with urea and heteroaryl as FPR2 modulators.
Molecular Weight:	143.57
Molecular Formula:	C6H6ClNO
Canonical SMILES:	C1=C(C=NC=C1Cl)CO
InChI:	InChI=1S/C6H6ClNO/c7-6-1-5(4-9)2-8-3-6/h1-3,9H,4H2
InChI Key:	ALUCWNPKIRQBEF-UHFFFAOYSA-N
Boiling Point:	258.8 °C at 760 mmHg
Density:	1.324 g/cm³
MDL:	MFCD09743969
LogP:	1.22730

Publication Number	Title	Priority Date
EP-3789378-A1	Piperidines or piperidones substituted with urea and heteroaryl	20190906
WO-2021032148-A1	Aminopyrazine compounds as hpk1 inhibitor and the use thereof	20190821
TW-201938533-A	Piperidine or piperidone substituted by urea and phenyl	20180309
WO-2019170904-A1	Piperidines or piperidones substituted with urea and phenyl	20180309
AU-2018313850-A1	Compounds, compositions and methods	20170809

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Complexity:	89.1
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	143.0137915
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	143.0137915
Rotatable Bond Count:	1
Topological Polar Surface Area:	33.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.6