2-(3-Chloro-2-pyridyl)acetic Acid - CAS 885167-73-7

Catalog:	BB038904
Product Name:	2-(3-Chloro-2-pyridyl)acetic Acid
CAS:	885167-73-7
Synonyms:	2-(3-chloro-2-pyridinyl)acetic acid; 2-(3-chloropyridin-2-yl)acetic acid

Technical Data

Patents

Computed Properties

IUPAC Name:	2-(3-chloropyridin-2-yl)acetic acid
Description:	2-(3-Chloro-2-pyridyl)acetic Acid (CAS# 885167-73-7) is a useful research chemical.
Molecular Weight:	171.58
Molecular Formula:	C7H6ClNO2
Canonical SMILES:	C1=CC(=C(N=C1)CC(=O)O)Cl
InChI:	InChI=1S/C7H6ClNO2/c8-5-2-1-3-9-6(5)4-7(10)11/h1-3H,4H2,(H,10,11)
InChI Key:	SAIMEUZXAQIFDD-UHFFFAOYSA-N
Boiling Point:	295.9 °C at 760 mmHg
Density:	1.405 g/cm³
LogP:	1.36210

Publication Number	Title	Priority Date
WO-2021104486-A1	Compound containing benzene ring and application thereof	20191129
US-2020031835-A1	Fused pyrazine derivatives as a2a / a2b inhibitors	20180705
EP-3818063-A1	Fused pyrazine derivatives as a2a / a2b inhibitors	20180705
WO-2017114510-A1	Compound having erk kinase inhibitory activity, method for preparation thereof, and use thereof	20151231
EP-3307715-A1	Aromatic sulfonamide derivatives	20150610

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Complexity:	151
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	171.0087061
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	171.0087061
Rotatable Bond Count:	2
Topological Polar Surface Area:	50.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1