6-Methoxyisoquinolin-1(2H)-one - CAS 26829-43-6

Catalog:	BB019373
Product Name:	6-Methoxyisoquinolin-1(2H)-one
CAS:	26829-43-6
Synonyms:	6-methoxy-2H-isoquinolin-1-one; 6-methoxy-2H-isoquinolin-1-one

Technical Data

Patents

Computed Properties

IUPAC Name:	6-methoxy-2H-isoquinolin-1-one
Description:	6-Methoxyisoquinolin-1(2H)-one (CAS# 26829-43-6) is a useful research chemical.
Molecular Weight:	175.18
Molecular Formula:	C10H9NO2
Canonical SMILES:	COC1=CC2=C(C=C1)C(=O)NC=C2
InChI:	InChI=1S/C10H9NO2/c1-13-8-2-3-9-7(6-8)4-5-11-10(9)12/h2-6H,1H3,(H,11,12)
InChI Key:	DDLJWWYULDUBGA-UHFFFAOYSA-N
Boiling Point:	438.478 °C at 760 mmHg
Density:	1.199 g/cm³
MDL:	MFCD11846296
LogP:	1.94900

Publication Number	Title	Priority Date
WO-2020123674-A1	Substituted arylmethylureas and heteroarylmethylureas, analogues thereof, and methods using same	20181212
TW-202035359-A	Substituted arylmethylureas and heteroarylmethylureas, analogues thereof, and methods using same	20181212
EP-3893645-A1	Substituted arylmethylureas and heteroarylmethylureas, analogues thereof, and methods using same	20181212
KR-20210102942-A	Substituted arylmethylureas and heteroarylmethylureas, analogs thereof, and methods of use thereof	20181212
CN-106117138-A	A kind of isoquinoline alkaloids alkaloid compound, its preparation method and application with antibacterial activity	20160629

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Related Functional Groups

Quinoline/Isoquinoline

[1936054-65-7]
2,4-Dichloro-3,6-dimethylquinoline
[30740-95-5]
6,7-Dimethoxy-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid hydrochloride
[13676-02-3]
2-Chloro-6-methoxyquinoline
[891782-60-8]
7-Bromo-3,4-dihydro-2H-isoquinolin-1-one
[7651-83-4]
7-Isoquinolinol
[1394843-51-6]
3-Hydroxy-1-methyl-6-nitroquinolin-2(1H)-one

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Complexity:	237
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	175.06332853
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	175.06332853
Rotatable Bond Count:	1
Topological Polar Surface Area:	38.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3