AG0039R4

521980-82-5 | Dimethyl 5-bromopyridine-2,3-dicarboxylate

AG0039R4

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CAS Number	521980-82-5
Catalog Number	AG0039R4(AGN-PC-09S2VV)
Chemical Name	Dimethyl 5-bromopyridine-2,3-dicarboxylate
IUPAC Name	dimethyl 5-bromopyridine-2,3-dicarboxylate
InChI	InChI=1S/C9H8BrNO4/c1-14-8(12)6-3-5(10)4-11-7(6)9(13)15-2/h3-4H,1-2H3
InChI Key	JYRYOIMMYLBBNZ-UHFFFAOYSA-N
MDL Number	MFCD09953248
Molecular Formula	C9H8BrNO4
Molecular Weight	274.0681
SMILES	BrC=1C=C(C(=NC1)C(=O)OC)C(=O)OC
Synonyms	DIMETHYL 5-BROMOPYRIDINE-2,3-DICARBOXYLATE, 521980-82-5, 5-Bromo-pyridine-2,3-dicarboxylic acid dimethyl ester, 2,3-Pyridinedicarboxylic acid, 5-bromo-, 2,3-dimethyl ester, SCHEMBL3699766, DTXSID80698424, JYRYOIMMYLBBNZ-UHFFFAOYSA-N, 7335AB, MFCD09953248, ZINC71625239, AKOS016009641, CS-W000545, RL03922, VP15108, AK111326, AS-48378, DA-05219, SC-14702, AB0049970, AJ-118413, AX8125349, FT-0698522, dimethyl 5-bromanylpyridine-2,3-dicarboxylate, Z-9158, A845875, DIMETHYL5-BROMOPYRIDINE-2,3-DICARBOXYLATE, J-520365, 5-bromopyridine-2,3-dicarboxylic acid dimethyl ester, C9H8BrNO4, 5-BROMOPYRIDINE-2,3-DICARBOXYLIC ACID, ACN-028349, 98555-51-2,

Complexity	259
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	272.964g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	274.07g/mol
Monoisotopic Mass	272.964g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	65.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

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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