4-Amino-1-naphthalenesulfonic acid - CAS 84-86-6

Catalog:	BB037343
Product Name:	4-Amino-1-naphthalenesulfonic acid
CAS:	84-86-6
Synonyms:	4-aminonaphthalene-1-sulfonic acid

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Computed Properties

IUPAC Name:	4-aminonaphthalene-1-sulfonic acid
Description:	4-Amino-1-naphthalenesulfonic acid (CAS# 84-86-6) is also a metabolite of azo dyes.
Molecular Weight:	223.25
Molecular Formula:	C10H9NO3S
Canonical SMILES:	C1=CC=C2C(=C1)C(=CC=C2S(=O)(=O)O)N
InChI:	InChI=1S/C10H9NO3S/c11-9-5-6-10(15(12,13)14)8-4-2-1-3-7(8)9/h1-6H,11H2,(H,12,13,14)
InChI Key:	NRZRRZAVMCAKEP-UHFFFAOYSA-N
Boiling Point:	434 °C
Density:	1.67 g/cm³
MDL:	MFCD00004027
LogP:	3.33070

Publication Number	Title	Priority Date
CN-113189186-A	Method for detecting atherosclerosis degree by utilizing endogenous heparin	20210506
CN-113346025-A	High-performance perovskite indoor photovoltaic device and preparation method thereof	20210430
CZ-34652-U1	Carbon material surface modified with poly (3,4-ethylenedioxothiophene)	20200930
JP-2020174059-A	Lead-acid batteries, idling stop system vehicles and micro-hybrid vehicles	20200729
CN-111583768-A	Method for making and color-keeping of plant flower and fruit dipping specimen	20200622

PMID	Publication Date	Title	Journal
22492166	20120801	Degradation kinetics of 4-amino naphthalene-1-sulfonic acid by a biofilm-forming bacterial consortium under carbon and nitrogen limitations	Journal of industrial microbiology & biotechnology
21880425	20111115	Post-treatment of anaerobically degraded azo dye Acid Red 18 using aerobic moving bed biofilm process: enhanced removal of aromatic amines	Journal of hazardous materials
19821606	20091101	Preparation of a library of EDTA amide x-aminenaphthalene-y-sulfonic acid derivatives on solid phase and their fluorescence behavior toward transition metals	Journal of combinatorial chemistry
19095036	20090201	Lack of genotoxic effect of food dyes amaranth, sunset yellow and tartrazine and their metabolites in the gut micronucleus assay in mice	Food and chemical toxicology : an international journal published for the British Industrial Biological Research Association
18577365	20080915	Detection of conformational changes in immunoglobulin G using isothermal titration calorimetry with low-molecular-weight probes	Analytical biochemistry

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GHS Hazard Statement:	H314 (93.62%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	322
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	223.03031432
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	223.03031432
Rotatable Bond Count:	1
Topological Polar Surface Area:	88.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.2