2-Aminonaphthalene-1,4-dione - CAS 2348-81-4

Catalog:	BB018074
Product Name:	2-Aminonaphthalene-1,4-dione
CAS:	2348-81-4
Synonyms:	2-aminonaphthalene-1,4-dione; 2-aminonaphthalene-1,4-dione

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Computed Properties

IUPAC Name:	2-aminonaphthalene-1,4-dione
Description:	2-Aminonaphthalene-1,4-dione (CAS# 2348-81-4 ) is a useful research chemical.
Molecular Weight:	173.17
Molecular Formula:	C10H7NO2
Canonical SMILES:	C1=CC=C2C(=C1)C(=O)C=C(C2=O)N
InChI:	InChI=1S/C10H7NO2/c11-8-5-9(12)6-3-1-2-4-7(6)10(8)13/h1-5H,11H2
InChI Key:	CYCRZLRIJWDWCM-UHFFFAOYSA-N
Boiling Point:	329.2 °C at 760 mmHg
Density:	1.351 g/cm³
LogP:	1.60850

Publication Number	Title	Priority Date
CN-113292503-A	Preparation method of 2-bromo-3-aminonaphthoquinone compound	20210522
JP-2021006572-A	Aminonaphthoquinone compounds, and pharmaceutical compositions for blocking the ubiquitination-proteasome system in disease	20201005
CN-110386889-A	A kind of synthetic method of NSC128981	20190629
CN-110386889-B	Synthesis method of NSC128981	20190629
US-2020102408-A1	Amino-quinone antipolymerants and methods of using	20180928

PMID	Publication Date	Title	Journal
22969654	20120901	N-(1,4-Dioxo-1,4-dihydro-naphthalen-2-yl)benzamide	Acta crystallographica. Section E, Structure reports online
21541428	20110901	Chirogenic [3 + 2]-photocycloaddition reactions of 2-substituted naphthoquinones with cyclic alkenes	Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology
20739172	20101015	A mediator-adapted diaphorase variant for a glucose dehydrogenase-diaphorase biocatalytic system	Biosensors & bioelectronics
20685433	20100630	Comparative study on 2-amino-1,4-naphthoquinone derived ligands as indium (III) selective PVC-based sensors	Talanta
20189692	20100601	Cytotoxicity of new alkylamino- and phenylamino-containing polyfluorinated derivatives of 1,4-naphthoquinone	European journal of medicinal chemistry

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Complexity:	293
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	173.047678466
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	173.047678466
Rotatable Bond Count:	0
Topological Polar Surface Area:	60.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.8