AG00177X

122433-41-4 | 3-​Pyridinecarboxylic acid, 5-​bromo-​2-​methoxy-​, methyl ester

AG00177X

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CAS Number	122433-41-4
Catalog Number	AG00177X(AGN-PC-0017HA)
Chemical Name	3-​Pyridinecarboxylic acid, 5-​bromo-​2-​methoxy-​, methyl ester
IUPAC Name	methyl 5-bromo-2-methoxypyridine-3-carboxylate
InChI	InChI=1S/C8H8BrNO3/c1-12-7-6(8(11)13-2)3-5(9)4-10-7/h3-4H,1-2H3
InChI Key	OLQOVEOEHQDKSC-UHFFFAOYSA-N
MDL Number	MFCD08064227
Molecular Formula	C8H8BrNO3
Molecular Weight	246.0580
SMILES	C(=O)(OC)c1c(OC)ncc(c1)Br
Synonyms	Methyl 5-Bromo-2-methoxynicotinate, 122433-41-4, methyl 5-bromo-2-methoxypyridine-3-carboxylate, Methyl 5-bromo-2-methoxy-3-pyridinecarboxylate, 3-Pyridinecarboxylic acid, 5-bromo-2-methoxy-, methyl ester, 5-Bromo-2-Methoxy-Nicotinic Acid Methyl Ester, MFCD08064227, Methyl 5-Bromo-2-Methoxynicotinate 98%, PubChem22054, ACMC-209akv, AC1Q42SO, SCHEMBL757419, CTK4B3108, DTXSID80559521, OLQOVEOEHQDKSC-UHFFFAOYSA-N, KS-000027FY, ANW-17981, SBB053830, ZINC12336792, AKOS005073332, AC-9433, LB-0733, MCULE-2004224601, PB25026, RP06008, RTR-003595, AJ-61092, BC004714, BL006350, BP-10227, AB0039763, TR-003595, 4CH-021942, 5-Bromo-2-methoxynicotinic acid methyl ester, CS-0007676, FT-0646878, ST24047979, ST50408691, Y7272, B-3506, Methyl 5-bromo-2-methoxynicotinate, AldrichCPR, W-205148, I14-26090, Methyl 5-bromo-2-methoxypyridine-3-carboxylate, 97%, 3-Pyridinecarboxylicacid, 5-bromo-2-methoxy-, methyl ester, C8H8BrNO3, ACN-028092, METHYL5-BROMO-2-METHOXYNICOTINATE, methyl 5-bromo-2-methoxypyridine-3-carboxylate, 95% - 1G 1g,

Complexity	188
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	244.969g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	246.06g/mol
Monoisotopic Mass	244.969g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	48.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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