6-Methylindoline - CAS 86911-82-2

Catalog:	BB038122
Product Name:	6-Methylindoline
CAS:	86911-82-2
Synonyms:	6-methyl-2,3-dihydro-1H-indole; 6-methyl-2,3-dihydro-1H-indole

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Computed Properties

IUPAC Name:	6-methyl-2,3-dihydro-1H-indole
Description:	6-Methylindoline (CAS# 86911-82-2 ) is a useful research chemical.
Molecular Weight:	133.19
Molecular Formula:	C9H11N
Canonical SMILES:	CC1=CC2=C(CCN2)C=C1
InChI:	InChI=1S/C9H11N/c1-7-2-3-8-4-5-10-9(8)6-7/h2-3,6,10H,4-5H2,1H3
InChI Key:	GYHSHGUXLJLVAR-UHFFFAOYSA-N
LogP:	2.10100

Publication Number	Title	Priority Date
WO-2021030620-A1	Heterocyclic compounds as kinase inhibitors	20190814
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WO-2020210377-A1	Heterocyclic compounds and uses thereof	20190409
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Related Functional Groups

Indolines

[32372-82-0]
Isoindoline hydrochloride
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[98660-18-5]
BLUE 203
[930790-08-2]
5-Phenoxyindoline
[845655-53-0]
6-Methyl-2-oxoindoline-3-carbaldehyde
[1002309-19-4]
2-Methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isoindolin-1-one

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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

Complexity:	122
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	133.089149355
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	133.089149355
Rotatable Bond Count:	0
Topological Polar Surface Area:	12 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3