AG00HUGZ

1361091-98-6 | 5-Methoxyquinoline-3-carboxylic acid

AG00HUGZ

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CAS Number	1361091-98-6
Catalog Number	AG00HUGZ(AGN-PC-0WCXSS)
Chemical Name	5-Methoxyquinoline-3-carboxylic acid
IUPAC Name	5-methoxyquinoline-3-carboxylic acid
InChI	InChI=1S/C11H9NO3/c1-15-10-4-2-3-9-8(10)5-7(6-12-9)11(13)14/h2-6H,1H3,(H,13,14)
InChI Key	IQTWNFKXMYNHOP-UHFFFAOYSA-N
MDL Number	MFCD21607487
Molecular Formula	C11H9NO3
Molecular Weight	203.1941
SMILES	O=C(C1=CC2=C(OC)C=CC=C2N=C1)O
Synonyms	5-METHOXYQUINOLINE-3-CARBOXYLIC ACID, 1361091-98-6, SCHEMBL2202272, DTXSID20631113, IQTWNFKXMYNHOP-UHFFFAOYSA-N, 5-methoxy-3-quinolinecarboxylic acid, MFCD21607487, ZINC59870799, AKOS025396509, 3-Quinolinecarboxylic acid, 5-methoxy-, AK174501, AS-41387, SC-68892,

Complexity	244
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	203.058g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	203.197g/mol
Monoisotopic Mass	203.058g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	59.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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