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Ethyl 4-Oxo-1,4-dihydroquinoline-6-carboxylate

Ethyl 4-Oxo-1,4-dihydroquinoline-6-carboxylate - CAS 127286-04-8

Name: Ethyl 4-Oxo-1,4-dihydroquinoline-6-carboxylate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB006782
Product Name:	Ethyl 4-Oxo-1,4-dihydroquinoline-6-carboxylate
CAS:	127286-04-8
Synonyms:	4-oxo-1H-quinoline-6-carboxylic acid ethyl ester; ethyl 4-oxo-1H-quinoline-6-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	ethyl 4-oxo-1H-quinoline-6-carboxylate
Description:	Ethyl 4-Oxo-1,4-dihydroquinoline-6-carboxylate (CAS# 127286-04-8 ) is a useful research chemical.
Molecular Weight:	217.22
Molecular Formula:	C12H11NO3
Canonical SMILES:	CCOC(=O)C1=CC2=C(C=C1)NC=CC2=O
InChI:	InChI=1S/C12H11NO3/c1-2-16-12(15)8-3-4-10-9(7-8)11(14)5-6-13-10/h3-7H,2H2,1H3,(H,13,14)
InChI Key:	HJEXAEIHROLMFS-UHFFFAOYSA-N
Storage:	Sealed in dry, 2-8 °C
LogP:	1.70480

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Related Functional Groups

Carbonyl Compounds

[89908-23-6]C23H22N2O5
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[1427004-19-0]C34H39N3O10
DBCO-PEG4-NHS ester
[1018141-88-2]C17H14N4O2
1-(2-Cyanoethyl)-3-methyl-6-phenyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
[1035840-45-9]C14H16N2O4
1-(5-Methoxy-1,3-benzoxazol-2-yl)piperidine-3-carboxylic acid
[17432-37-0]C11H14O
2,3,5,6-Tetramethylbenzaldehyde
[108397-75-7]C8H10N2O2
2,4,6-Trimethylpyrimidine-5-carboxylic Acid

Publication Number	Title	Priority Date
ES-2454769-T3	Nitrogen ring acylguanidine derivative	20090806
US-2008234267-A1	Compounds and Methods of Treatment	20070320
US-2011053934-A1	Compounds and methods of treatment	20070320
CA-2114727-C	Quinoline derivatives as immunostimulants	19910802
EP-0597003-A1	Quinoline derivatives as immunostimulants	19910802

Complexity:	324
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	217.07389321
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	217.07389321
Rotatable Bond Count:	3
Topological Polar Surface Area:	55.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.8