6-Aminoindolin-2-one - CAS 150544-04-0

Name: 6-Aminoindolin-2-one
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB010552
Product Name:	6-Aminoindolin-2-one
CAS:	150544-04-0
Synonyms:	6-amino-1,3-dihydroindol-2-one; 6-amino-1,3-dihydroindol-2-one

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Computed Properties

IUPAC Name:	6-amino-1,3-dihydroindol-2-one
Description:	6-Aminoindolin-2-one (CAS# 150544-04-0) is a useful research chemical.
Molecular Weight:	148.16
Molecular Formula:	C8H8N2O
Canonical SMILES:	C1C2=C(C=C(C=C2)N)NC1=O
InChI:	InChI=1S/C8H8N2O/c9-6-2-1-5-3-8(11)10-7(5)4-6/h1-2,4H,3,9H2,(H,10,11)
InChI Key:	OCOCBVKMMMIDLI-UHFFFAOYSA-N
Boiling Point:	394.3 °C at 760 mmHg
Density:	1.307 g/cm³
LogP:	1.48260

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Related Functional Groups

Indoles

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[116952-58-0]C14H18N2O3
2-Ethoxycarbonyl-5-methoxytryptamine
[20776-45-8]C17H18N2O
5-Benzyloxytryptamine
[53995-78-1]C11H9Cl2NO2
Ethyl 5,6-dichloro-1H-indole-2-carboxylate
[171780-79-3]C9H10N2O
5-Methoxy-7-methyl-4-azaindole
[1375064-65-5]C11H9BrClNO2
Ethyl 3-Bromo-5-chloroindole-1-carboxylate

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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

Publication Number	Title	Priority Date
WO-2021003314-A1	Heterocyclic compounds as kinase inhibitors	20190702
WO-2020181232-A1	Heterocyclic compounds for medical treatment	20190306
CN-110769821-A	Spirocyclic indolines as IL-17 modulators	20170614
EP-3638227-A1	Spirocyclic indolines as il-17 modulators	20170614
US-2020138797-A1	Spirocyclic Indolines as IL-17 Modulators	20170614

Complexity:	181
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	148.063662883
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	148.063662883
Rotatable Bond Count:	0
Topological Polar Surface Area:	55.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.5