AG005V2A

948290-16-2 | Ethyl 7-bromo-2-methylquinoline-3-carboxylate

AG005V2A

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CAS Number	948290-16-2
Catalog Number	AG005V2A(AGN-PC-01A9PS)
Chemical Name	Ethyl 7-bromo-2-methylquinoline-3-carboxylate
IUPAC Name	ethyl 7-bromo-2-methylquinoline-3-carboxylate
InChI	InChI=1S/C13H12BrNO2/c1-3-17-13(16)11-6-9-4-5-10(14)7-12(9)15-8(11)2/h4-7H,3H2,1-2H3
InChI Key	PYRVSBADHBVVGL-UHFFFAOYSA-N
MDL Number	MFCD09787848
Molecular Formula	C13H12BrNO2
Molecular Weight	294.1439
SMILES	O=C(C1=CC2=CC=C(Br)C=C2N=C1C)OCC
Synonyms	948290-16-2, Ethyl 7-bromo-2-methylquinoline-3-carboxylate, 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester, CTK8C2960, DTXSID90589157, 6286AC, ANW-69363, MFCD09787848, ZINC32099602, AKOS016006360, AB52374, AJ-84695, OR309222, AX8220588, DB-080049, RT-010775, FT-0747791, T6790, 7-Bromo-2-methylquinoline-3-carboxylic acid ethyl ester, AldrichCPR, C13H12BrNO2, Ethyl7-bromo-2-methylquinoline-3-carboxylate,

Complexity	285
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	293.005g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	294.148g/mol
Monoisotopic Mass	293.005g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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