AG01DTSR

Name: 3-Quinolinecarboxylic acid, 4-hydroxy-8-iodo-,ethyl ester
Brand: Angene Chemical
SKU: AG01DTSR

49713-42-0 | 3-Quinolinecarboxylic acid, 4-hydroxy-8-iodo-,ethyl ester

AG01DTSR

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COA

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CAS Number	49713-42-0
Catalog Number	AG01DTSR
Chemical Name	3-Quinolinecarboxylic acid, 4-hydroxy-8-iodo-,ethyl ester
IUPAC Name	ethyl 8-iodo-4-oxo-1H-quinoline-3-carboxylate
InChI	InChI=1S/C12H10INO3/c1-2-17-12(16)8-6-14-10-7(11(8)15)4-3-5-9(10)13/h3-6H,2H2,1H3,(H,14,15)
InChI Key	HQRQWIBERSITPY-UHFFFAOYSA-N
MDL Number	MFCD06808574
Molecular Formula	C12H10INO3
Molecular Weight	343.1172
SMILES	O=C(C1=C(O)C2=CC=CC(I)=C2N=C1)OCC
Synonyms	49713-42-0, 205597-70-2, 3-Quinolinecarboxylic acid, 4-hydroxy-8-iodo-,ethyl ester, ethyl 4-hydroxy-8-iodo-3-quinolinecarboxylate, 3-Quinolinecarboxylic acid, 1,4-dihydro-8-iodo-4-oxo-, ethyl ester, SCHEMBL1244789, CTK0J8720, DTXSID60496602, HQRQWIBERSITPY-UHFFFAOYSA-N, 3-Quinolinecarboxylic acid, 4-hydroxy-8-iodo-, ethyl ester, ZINC39221579, AKOS030566331, Ethyl 8-iodo-4-oxo-1,4-dihydroquinoline-3-carboxylate, 1,4-Dihydro-4-oxo-8-iodoquinoline-3-carboxylic acid ethyl ester, 8-iodo-4-oxo-1,4-dihydro-quinoline-3-carboxylic acid ethyl ester, ethyl 8-iodo-4-oxo-1H-quinoline-3-carboxylate,

Complexity	367
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	342.971g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	343.12g/mol
Monoisotopic Mass	342.971g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.6

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited