AG003RU5

54113-41-6 | Methyl 4,5-dibromo-2-furoate

AG003RU5

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CAS Number	54113-41-6
Catalog Number	AG003RU5(AGN-PC-0L5Y1B)
Chemical Name	Methyl 4,5-dibromo-2-furoate
IUPAC Name	methyl 4,5-dibromofuran-2-carboxylate
InChI	InChI=1S/C6H4Br2O3/c1-10-6(9)4-2-3(7)5(8)11-4/h2H,1H3
InChI Key	OIOPUTCGINQNRL-UHFFFAOYSA-N
MDL Number	MFCD00092493
Molecular Formula	C6H4Br2O3
Molecular Weight	283.9022
SMILES	COC(=O)C1=CC(Br)=C(Br)O1
Synonyms	Methyl 4,5-dibromo-2-furoate, 54113-41-6, Methyl 4,5-dibromofuran-2-carboxylate, 2-Furancarboxylic acid, 4,5-dibromo-, methyl ester, methyl 4,5-dibromo-2-furancarboxylate, AK-67852, 4,5-Dibromo-2-furancarboxylic acid methyl ester, METHYL-4,5-DIBROMO-2-FUROATE, AC1N4V8D, AC1Q42Z7, SCHEMBL1198786, CTK4J9655, KS-00000BQQ, DTXSID30399732, OIOPUTCGINQNRL-UHFFFAOYSA-N, ZINC399962, 7773AB, ANW-57146, METHYL4,5-DIBROMO-2-FUROATE, MFCD00092493, AKOS016002670, FCH1329972, MCULE-3321710394, TRA0016107, WT82100, 4,5-Dibromo-2-furoic Acid Methyl Ester, AJ-21759, QC-10359, SY023311, AX8208804, TX-011978, CS-0011220, M2876, ST24031058, MFCD00092493 (95+%), 2,3-dibromo-furan-5-carboxylic acid methyl ester, 4,5-DIBROMOFURAN-2-CARBOXYLIC ACID METHYL ESTER, C6H4Br2O3, CID4135083,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	283.851g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	283.903g/mol
Monoisotopic Mass	281.853g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	39.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.9

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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