4-Chloro-7-methoxyquinoline - CAS 68500-37-8

Catalog:	BB033561
Product Name:	4-Chloro-7-methoxyquinoline
CAS:	68500-37-8
Synonyms:	4-chloro-7-methoxyquinoline; 4-chloro-7-methoxyquinoline

Technical Data

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Computed Properties

IUPAC Name:	4-chloro-7-methoxyquinoline
Description:	4-Chloro-7-methoxyquinoline (CAS# 68500-37-8) is a useful research chemical.
Molecular Weight:	193.63
Molecular Formula:	C10H8ClNO
Canonical SMILES:	COC1=CC2=NC=CC(=C2C=C1)Cl
InChI:	InChI=1S/C10H8ClNO/c1-13-7-2-3-8-9(11)4-5-12-10(8)6-7/h2-6H,1H3
InChI Key:	UKTYNFPTZDSBLR-UHFFFAOYSA-N
Boiling Point:	299.881 °C at 760 mmHg
Density:	1.268 g/cm³
MDL:	MFCD06659036
LogP:	2.89680

Publication Number	Title	Priority Date
CN-112500341-A	Synthesis method of 7-hydroxyquinoline-4-carboxylic acid	20201116
WO-2021043245-A1	Hydantoin derivative	20190906
KR-20210015730-A	Oxo-pyridine fused ring derivatives and pharmaceutical composition containing the same	20190802
WO-2021025407-A1	Oxo-pyridine fusion ring derivative and pharmaceutical composition comprising same	20190802
WO-2020188049-A1	Quinoline derivatives, processes for their preparation and uses thereof for the treatment of cancer	20190320

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4-Hydroxy-6-methoxyquinoline-3-carboxylic acid ethyl ester

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GHS Hazard Statement:	H302 (92.68%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P264, P270, P280, P301+P312, P305+P351+P338, P310, P330, and P501
Signal Word:	Danger

Complexity:	176
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	193.0294416
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	193.0294416
Rotatable Bond Count:	1
Topological Polar Surface Area:	22.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.9