AG0070CW

13457-28-8 | Methyl 3-bromo-6-chloropyrazine-2-carboxylate

AG0070CW

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CAS Number	13457-28-8
Catalog Number	AG0070CW(AGN-PC-0BKEC4)
Chemical Name	Methyl 3-bromo-6-chloropyrazine-2-carboxylate
IUPAC Name	methyl 3-bromo-6-chloropyrazine-2-carboxylate
InChI	InChI=1S/C6H4BrClN2O2/c1-12-6(11)4-5(7)9-2-3(8)10-4/h2H,1H3
InChI Key	NJAYXNFNZKQGNE-UHFFFAOYSA-N
MDL Number	MFCD13195362
Molecular Formula	C6H4BrClN2O2
Molecular Weight	251.4652
SMILES	O=C(C1=NC(Cl)=CN=C1Br)OC
Synonyms	Methyl 3-bromo-6-chloropyrazine-2-carboxylate, 13457-28-8, AK-31196, 3-bromo-6-chloro-pyrazine-2-carboxylic acid methyl ester, CTK4B9282, DTXSID00718759, MFCD13195362, ZINC71790994, AKOS015834151, FCH1382235, QC-6922, DS-11789, AB0096801, AJ-118651, AX8212956, ST1120860, TR-035639, CS-0049109, FT-0768443, Methyl 3-bromo-6-chloropyrazine-2-carboxylate, AldrichCPR,

Complexity	181
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	249.914g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	251.464g/mol
Monoisotopic Mass	249.914g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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