5-Chlorobenzofuran-2-carboxylic Acid - CAS 10242-10-1

Catalog:	BB000856
Product Name:	5-Chlorobenzofuran-2-carboxylic Acid
CAS:	10242-10-1
Synonyms:	5-chloro-2-benzofurancarboxylic acid; 5-chloro-1-benzofuran-2-carboxylic acid

Technical Data

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Patents

Literatures

Computed Properties

IUPAC Name:	5-chloro-1-benzofuran-2-carboxylic acid
Description:	5-Chlorobenzofuran-2-carboxylic Acid (CAS# 10242-10-1) is a useful research chemical.
Molecular Weight:	196.59
Molecular Formula:	C9H5ClO3
Canonical SMILES:	C1=CC2=C(C=C1Cl)C=C(O2)C(=O)O
InChI:	InChI=1S/C9H5ClO3/c10-6-1-2-7-5(3-6)4-8(13-7)9(11)12/h1-4H,(H,11,12)
InChI Key:	JETRXAHRPACNMA-UHFFFAOYSA-N
Boiling Point:	348.8 °C at 760 mmHg
Density:	1.502 g/cm³
Appearance:	Solid
Storage:	Sealed in dry, 2-8 °C
MDL:	MFCD00060512
LogP:	2.78440

Publication Number	Title	Priority Date
KR-20210008819-A	Benzofuran-based n-acylhydrazone derivatives and pharmaceutical composition comprising the same	20190715
WO-2021010731-A1	Benzofuran-based n-acylhydrazone derivative and pharmaceutical composition comprising same	20190715
WO-2020252205-A1	Inhibitors of integrated stress response pathway	20190612
US-2021317102-A1	Inhibitors of integrated stress response pathway	20190612
US-2020270232-A1	Inhibitors of integrated stress response pathway	20190225

PMID	Publication Date	Title	Journal
15115392	20040506	Non-peptidic small-molecule inhibitors of the single-chain hepatitis C virus NS3 protease/NS4A cofactor complex discovered by structure-based NMR screening	Journal of medicinal chemistry

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[87-88-7]
Chloranilic acid
[17746-05-3]
Undecanoyl chloride
[70199-62-1]
(4-Pyridyl)acetone Hydrochloride
[35153-16-3]
(Z)-10-Tetradecenyl Acetate

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	219
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	195.9927217
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	195.9927217
Rotatable Bond Count:	1
Topological Polar Surface Area:	50.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3