AG00ICK9

74840-99-6 | Ethyl 4，5-dibromo-1H-imidazole-2-carboxylate

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CAS Number	74840-99-6
Catalog Number	AG00ICK9(AGN-PC-0WAMEJ)
Chemical Name	Ethyl 4，5-dibromo-1H-imidazole-2-carboxylate
IUPAC Name	ethyl 4,5-dibromo-1H-imidazole-2-carboxylate
InChI	InChI=1S/C6H6Br2N2O2/c1-2-12-6(11)5-9-3(7)4(8)10-5/h2H2,1H3,(H,9,10)
InChI Key	RAKBRBUOFBTKPC-UHFFFAOYSA-N
MDL Number	MFCD21496615
Molecular Formula	C6H6Br2N2O2
Molecular Weight	297.9320
SMILES	O=C(C1=NC(Br)=C(Br)N1)OCC
Synonyms	ethyl 4,5-dibromo-1H-imidazole-2-carboxylate, 74840-99-6, AK187864, IMI049, DTXSID60504958, MFCD21496615, ZINC39256571, AKOS025404446, DS-9837, FCH1565922, AX8331750, CS-0054330, 1H-Imidazole-2-carboxylic acid, 4,5-dibromo-, ethyl ester,

Complexity	179
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	297.878g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	297.934g/mol
Monoisotopic Mass	295.88g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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