AG002KIW

210037-58-4 | 2-Pyrazinecarboxylic acid, 5-bromo-, methyl ester

AG002KIW

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CAS Number	210037-58-4
Catalog Number	AG002KIW(AGN-PC-059B9Y)
Chemical Name	2-Pyrazinecarboxylic acid, 5-bromo-, methyl ester
IUPAC Name	methyl 5-bromopyrazine-2-carboxylate
InChI	InChI=1S/C6H5BrN2O2/c1-11-6(10)4-2-9-5(7)3-8-4/h2-3H,1H3
InChI Key	PVTAJWAGBTWOPG-UHFFFAOYSA-N
MDL Number	MFCD09991715
Molecular Formula	C6H5BrN2O2
Molecular Weight	217.0201
SMILES	BrC=1N=CC(=NC1)C(=O)OC
Synonyms	METHYL 5-BROMOPYRAZINE-2-CARBOXYLATE, 210037-58-4, 5-Bromo-pyrazine-2-carboxylic acid methyl ester, MFCD09991715, Pyrazinecarboxylic acid, 5-bromo-, methyl ester, 2-Pyrazinecarboxylic acid, 5-bromo-, methyl ester, KSC545M4B, AMPZ0012, SCHEMBL2134366, CTK4E5640, DTXSID90650730, PVTAJWAGBTWOPG-UHFFFAOYSA-N, BCP23175, KS-00000GM5, ANW-49703, QC-489, ZINC16698203, AKOS015834997, CS-W019731, MB08354, MCULE-4586904305, RP27031, RTR-009870, AC-28839, AJ-69486, AK-24801, BR-24801, CJ-15634, DS-10767, SY018538, 5-Bromopyrazinecarboxylic acid methyl ester, AB0023358, DB-066403, TR-009870, 4CH-006375, AM20070324, FT-0650438, ST24033261, W4394, MFCD09991715 (98%), 5-Bromopyrazine-2-carboxylic acid methyl ester, S-5942, 2-Pyrazinecarboxylicacid, 5-bromo-, methyl ester, Q-103339, 5-BROMO-2-PYRAZINECARBOXYLIC ACID METHYL ESTER, C6H5BrN2O2, METHYL5-BROMOPYRAZINE-2-CARBOXYLATE, Pyrazinecarboxylicacid,5-bromo-,methylester, Methyl 5-bromopyrazine-2-carboxylate, 95% - 1G 1g,

Complexity	154
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	215.953g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	217.022g/mol
Monoisotopic Mass	215.953g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	52.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

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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