2-Methoxy-1,4-naphthoquinone - CAS 2348-82-5

Catalog:	BB018075
Product Name:	2-Methoxy-1,4-naphthoquinone
CAS:	2348-82-5
Synonyms:	2-methoxynaphthalene-1,4-dione

Technical Data

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Computed Properties

IUPAC Name:	2-methoxynaphthalene-1,4-dione
Description:	2-Methoxy-1,4-naphthoquinone, isolated from the leaves of Impatiens glandulifera, is a potential candidate for Helicobacter pylori infection related disease therapy.
Molecular Weight:	188.18
Molecular Formula:	C11H8O3
Canonical SMILES:	COC1=CC(=O)C2=CC=CC=C2C1=O
InChI:	InChI=1S/C11H8O3/c1-14-10-6-9(12)7-4-2-3-5-8(7)11(10)13/h2-6H,1H3
InChI Key:	OBGBGHKYJAOXRR-UHFFFAOYSA-N
Boiling Point:	339.8 ℃ at 760 mmHg
Purity:	≥ 95 %
Density:	1.28 g/cm³
Appearance:	Solid powder
MDL:	MFCD00019539
LogP:	1.59590

Publication Number	Title	Priority Date
CN-113456681-A	Emulsifiable paste preparation and preparation method and application thereof	20210714
CN-112961674-A	Preparation method and application of antifungal 2-methoxy-1, 4-naphthoquinone-based fluorescent carbon dots	20210205
CN-112175102-A	Preparation method and application of algal polysaccharide disease-resistant inducer	20201027
CN-111208222-A	Method for detecting content of 2-methoxy-1, 4-naphthoquinone in impatiens balsamina medicinal material	20200110
EP-3854455-A1	Ttp phosphorylation as a biomarker in targeted therapy	20191211

PMID	Publication Date	Title	Journal
24291160	20140401	2-Methoxy-1,4-Naphthoquinone (MNQ) suppresses the invasion and migration of a human metastatic breast cancer cell line (MDA-MB-231)	Toxicology in vitro : an international journal published in association with BIBRA
22795899	20120815	New oxirane derivatives of 1,4-naphthoquinones and their evaluation against T. cruzi epimastigote forms	Bioorganic & medicinal chemistry
21717278	20120101	Evaluation of plumbagin and its derivative as potential modulators of redox thiol metabolism of Leishmania parasite	Parasitology research
21754213	20110401	2-Meth-oxy-naphthalene-1,4-dione	Acta crystallographica. Section E, Structure reports online
19773391	20110101	In Vitro Activity of 2-methoxy-1,4-naphthoquinone and Stigmasta-7,22-diene-3β-ol from Impatiens balsamina L. against Multiple Antibiotic-Resistant Helicobacter pylori	Evidence-based complementary and alternative medicine : eCAM

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Related Functional Groups

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2-(6-Methyl-2-pyridyl)acetic Acid Hydrochloride

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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:	304
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	188.047344113
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	188.047344113
Rotatable Bond Count:	1
Topological Polar Surface Area:	43.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.4