6-Aminoindole - CAS 5318-27-4

Catalog:	BB028077
Product Name:	6-Aminoindole
CAS:	5318-27-4
Synonyms:	1H-indol-6-amine

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	1H-indol-6-amine
Description:	6-Aminoindole (CAS# 5318-27-4) is a useful research chemical. It functions as an intermediate used in the synthesis of pyrimidine analogs that function as a non-covalent BTK inhibitors.
Molecular Weight:	132.16
Molecular Formula:	C8H8N2
Canonical SMILES:	C1=CC(=CC2=C1C=CN2)N
InChI:	InChI=1S/C8H8N2/c9-7-2-1-6-3-4-10-8(6)5-7/h1-5,10H,9H2
InChI Key:	MIMYTSWNVBMNRH-UHFFFAOYSA-N
Boiling Point:	161-166 °C / 2 mmHg
Melting Point:	75-79 °C
Purity:	95 %
Density:	1.268 g/cm³
Storage:	Keep Cold
MDL:	MFCD02093959
LogP:	2.33130

Publication Number	Title	Priority Date
WO-2021125352-A1	METHOD FOR SYNTHESIZING CELOSIANIN II, METHOD FOR SYNTHESIZING BETAXANTHIN, AMYLOID-Î² POLYMERIZATION INHIBITOR OR THERAPEUTIC OR PROPHYLACTIC AGENT FOR ALZHEIMER'S DISEASE, AMYLOID PEPTIDE AGGREGATION INHIBITOR, AND HIV-1 PROTEASE ACTIVITY INHIBITOR	20191219
WO-2021127166-A1	Inhibitors of enl/af9 yeats	20191217
WO-2021028643-A1	Heterocyclic compounds for use in the treatment of cancer	20190809
WO-2021018445-A1	Oxidant-free method for dyeing keratin material, comprising the application of an organic c1-c6-alkoxy silane and an oxidant-free dye precursor	20190801
WO-2020257621-A1	Methods of treating cancer	20190621

PMID	Publication Date	Title	Journal
20169066	20100216	Modulation of alpha-synuclein aggregation by dopamine analogs	PloS one

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Related Functional Groups

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Indole-3-carboxylic acid

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	124
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	132.068748264
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	132.068748264
Rotatable Bond Count:	0
Topological Polar Surface Area:	41.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9