8-Methyl-2(1H)-quinolinone - CAS 4053-36-5

Name: 8-Methyl-2(1H)-quinolinone
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB024557
Product Name:	8-Methyl-2(1H)-quinolinone
CAS:	4053-36-5
Synonyms:	8-methyl-1H-quinolin-2-one; 8-methyl-1H-quinolin-2-one

Technical Data

Patents

Computed Properties

IUPAC Name:	8-methyl-1H-quinolin-2-one
Description:	8-Methyl-2(1H)-quinolinone (CAS# 4053-36-5 ) is a useful research chemical.
Molecular Weight:	159.18
Molecular Formula:	C10H9NO
Canonical SMILES:	CC1=CC=CC2=C1NC(=O)C=C2
InChI:	InChI=1S/C10H9NO/c1-7-3-2-4-8-5-6-9(12)11-10(7)8/h2-6H,1H3,(H,11,12)
InChI Key:	XXPVCQMOIBCSDT-UHFFFAOYSA-N
LogP:	2.24880

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Related Functional Groups

Quinoline/Isoquinoline

[948291-36-9]C11H7Cl2NO
2,5-Dichloro-8-methylquinoline-3-carboxaldehyde
[91092-92-1]C11H9NO4
3-Carbomethoxy-1,2,3,4-tetrahydroisoquinoline-1,4-dione
[30740-95-5]C12H16ClNO4
6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid hydrochloride
[77156-78-6]C13H13NO4
4-Hydroxy-6-methoxyquinoline-3-carboxylic acid ethyl ester
[1535306-28-5]C9H5FINO
6-Fluoro-8-iodoquinolin-2(1H)-one
[891782-60-8]C9H8BrNO
7-Bromo-3,4-dihydro-2H-isoquinolin-1-one

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Publication Number	Title	Priority Date
WO-2021083167-A1	Substituted heterocyclic fused cyclic compound, preparation method therefor and pharmaceutical use thereof	20191030
KR-20210040085-A	TLR7/8 antagonist and uses thereof	20180731
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EP-3604281-A1	2(1h)-quinolinone derivative	20170324

Complexity:	222
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	159.068413911
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	159.068413911
Rotatable Bond Count:	0
Topological Polar Surface Area:	29.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7