AG002LKA

22931-71-1 | 3-Quinolinecarboxylic acid, 4-chloro-6-methoxy-, ethyl ester

AG002LKA

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CAS Number	22931-71-1
Catalog Number	AG002LKA(AGN-PC-0JOOKY)
Chemical Name	3-Quinolinecarboxylic acid, 4-chloro-6-methoxy-, ethyl ester
IUPAC Name	ethyl 4-chloro-6-methoxyquinoline-3-carboxylate
InChI	InChI=1S/C13H12ClNO3/c1-3-18-13(16)10-7-15-11-5-4-8(17-2)6-9(11)12(10)14/h4-7H,3H2,1-2H3
InChI Key	QURGQUFEJWWDRF-UHFFFAOYSA-N
MDL Number	MFCD00173417
Molecular Formula	C13H12ClNO3
Molecular Weight	265.6923
NSC Number	196908
SMILES	ClC1=C(C=NC2=CC=C(C=C12)OC)C(=O)OCC
Synonyms	ethyl 4-chloro-6-methoxyquinoline-3-carboxylate, 22931-71-1, GNF-Pf-3551, 4-Chloro-6-methoxyquinoline-3-carboxylic acid ethyl ester, 4-Chloro-6-methoxy-quinoline-3-carboxylic acid ethyl ester, QURGQUFEJWWDRF-UHFFFAOYSA-N, MFCD00173417, Ethyl 4-chloro-6-methoxy-3-quinolinecarboxylate, NSC196908, ACMC-20a6z6, AC1Q32YV, Oprea1_016451, SCHEMBL544894, AC1L758T, CHEMBL601324, KS-00001YER, DTXSID30307938, ZINC140166, ACT10472, ANW-59968, SBB079140, STL331620, AKOS000181060, CCG-108125, MCULE-4384269758, NSC-196908, RP29459, 3-Carbethoxy-4-chloro-6-methoxyquinoline, AJ-12393, BAS 02168901, DB-031204, TC-148713, 4-chloro-3-ethoxycarbonyl-6-methoxyquinoline, 6-methoxy-4-chloro-3-ethoxycarbonylquinoline, AM20050972, EU-0073812, FT-0646041, ST50182441, T6457, ethyl 4chloro-6methoxyquinoline-3-carboxylate, 6J-071, ethyl 4-chloro-6-methoxyquinolin-3-carboxylate, 931C711, Ethyl 4-chloro-6-methoxy-3-quinolinecarboxylate #, Ethyl 4-chloro-6-methoxy-quinoline-3-carboxylate, SR-01000453170, I08-1367, J-520994, SR-01000453170-1, 3-Quinolinecarboxylic acid, 4-chloro-6-methoxy-, ethyl ester, 4-Chloro-6-methoxyquinoline-3-carboxylic acid ethyl ester, AldrichCPR, CID304558, Ethyl 4-chloro-6-methoxyquinoline-3-carboxylate, 97% 250mg,

Complexity	300
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	265.051g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	265.693g/mol
Monoisotopic Mass	265.051g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	48.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

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