AG003QD9

2199-90-8 | ETHYL 6-BROMO-2-OXO-2H-CHROMENE-3-CARBOXYLATE

AG003QD9

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CAS Number	2199-90-8
Catalog Number	AG003QD9(AGN-PC-0JV0AX)
Chemical Name	ETHYL 6-BROMO-2-OXO-2H-CHROMENE-3-CARBOXYLATE
IUPAC Name	ethyl 6-bromo-2-oxochromene-3-carboxylate
InChI	InChI=1S/C12H9BrO4/c1-2-16-11(14)9-6-7-5-8(13)3-4-10(7)17-12(9)15/h3-6H,2H2,1H3
InChI Key	RXGDNKCWEKUYQA-UHFFFAOYSA-N
MDL Number	MFCD00124584
Molecular Formula	C12H9BrO4
Molecular Weight	297.1015
SMILES	O=C(C(C1=O)=CC2=C(O1)C=CC(Br)=C2)OCC
Synonyms	ethyl 6-bromo-2-oxo-2H-chromene-3-carboxylate, ethyl 6-bromo-OCC, ethyl 6-bromo-2-oxo-2H-chromene-3-carboxylate, 2199-90-8, Ethyl 6-Bromocoumarin-3-carboxylate, ethyl 6-bromo-2-oxochromene-3-carboxylate, ST057448, 6-Bromocoumarin-3-carboxylic Acid Ethyl Ester, AC1LESNX, BAS 00852496, ACMC-1CGNB, Oprea1_573298, Oprea1_663499, AC1Q26Z5, IFLab1_000491, CHEMBL1650557, SCHEMBL11484256, CTK4E8193, ZINC62926, DTXSID40351124, 6-bromo-3-ethoxycarbonyl coumarin, RXGDNKCWEKUYQA-UHFFFAOYSA-N, HMS1413G07, Ethyl6-Bromocoumarin-3-carboxylate, ALBB-025156, CCG-1077, KS-000015WZ, ZX-AN023670, ANW-24662, MFCD00124584, QC-382, SBB006386, STK386374, AKOS000400825, ACN-025613, MCULE-4398793405, TRA0073374, IDI1_008710, NCGC00309490-01, 6-Bromocoumarin-3-carboxylicacidethylester, AJ-09993, AS-42057, AB0081661, AX8261821, TR-010329, E0733, FT-0728628, R2197, AB00080033-01, AB00080033-03, SR-01000391454, J-014410, SR-01000391454-1, I14-59065, F0110-0091, 6-Bromo-2-oxo-2H-chromene-3-carboxylic acid ethyl ester, A1265/0057842, 2-Oxo-6-bromo-2H-1-benzopyran-3-carboxylic acid ethyl ester, 2H-1-Benzopyran-3-carboxylic acid, 6-bromo-2-oxo-, ethyl ester, 2H-1-Benzopyran-3-carboxylicacid, 6-bromo-2-oxo-, ethyl ester, C12H9BrO4, AR-1I9513, CID691747, 22098-38-0,

Complexity	364
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	295.968g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	297.104g/mol
Monoisotopic Mass	295.968g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H302
Precuationary statements	P264-P270-P301+P312-P330
Siginal words

Certificate of Analysis

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