1-Acetylindoline - CAS 16078-30-1

Catalog:	BB011668
Product Name:	1-Acetylindoline
CAS:	16078-30-1
Synonyms:	1-(2,3-dihydroindol-1-yl)ethanone

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	1-(2,3-dihydroindol-1-yl)ethanone
Description:	1-Acetylindoline (CAS# 16078-30-1) is an intermediate used for preparation of triazolothiadiazepine dioxide derivatives, halo-substituted aromatic amides and [[(phenyl)piperazinyl]alkyl]indolyl]ethanone.
Molecular Weight:	161.20
Molecular Formula:	C10H11NO
Canonical SMILES:	CC(=O)N1CCC2=CC=CC=C21
InChI:	InChI=1S/C10H11NO/c1-8(12)11-7-6-9-4-2-3-5-10(9)11/h2-5H,6-7H2,1H3
InChI Key:	RNTCWULFNYNFGI-UHFFFAOYSA-N
Boiling Point:	355.1 °C at 760 mmHg
Density:	1.144 g/cm³
Appearance:	White to off-white powder or crystalline powder
MDL:	MFCD00022908
LogP:	1.66060

Publication Number	Title	Priority Date
CN-113149886-A	Synthesis method of silodosin	20210330
WO-2021072369-A1	Lpxh targeting compounds, compositions thereof, and methods of making and using the same	20191011
CN-110038556-B	OMS-2 type composite material with mixed crystal phase, preparation method and application thereof	20190506
EP-3653208-A1	Compounds that selectively and effectively inhibit hakai-mediated ubiquitination, as anti-cancer drugs	20181115
CN-109111427-A	A kind of Benzazole compounds and its application, a kind of pharmaceutical composition and its application	20170622

PMID	Publication Date	Title	Journal
21522761	20101208	(RS)-1-[5-(2-Chloro-prop-yl)indolin-1-yl]ethanone	Acta crystallographica. Section E, Structure reports online
21587848	20100609	(RS)-1-(1-Acetyl-indolin-5-yl)-2-chloro-propan-1-one	Acta crystallographica. Section E, Structure reports online
21202937	20080619	1-Acetyl-5,6-dimethoxy-indoline at 123 K	Acta crystallographica. Section E, Structure reports online

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Related Functional Groups

Carbonyl Compounds

[91125-43-8]
Sulfophenyl nonanoate sodium salt
[5650-34-0]
Oxiran-2-yl(phenyl)methanone
[51493-02-8]
N-Methyl-N-propylcarbamoyl Chloride
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[55441-25-3]
1-(2-Cyanophenyl)urea
[1035840-45-9]
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid

Indoles

[1884330-89-5]
1-Methyl-1H-indole-5-D
[2170450-99-2]
4-Methyl-1-(phenylsulfonyl)-1H-indole-2-carbonitrile
[37033-95-7]
Ethyl 5-(benzyloxy)-1H-indole-2-carboxylate
[6960-46-9]
Ethyl 7-nitroindole-2-carboxylate
[1477-50-5]
Indole-2-carboxylic acid
[1670-81-1]
Indole-5-carboxylic acid

Complexity:	190
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	161.084063974
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	161.084063974
Rotatable Bond Count:	0
Topological Polar Surface Area:	20.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3