AG002SB4

26218-78-0 | 3-Pyridinecarboxylic acid, 6-bromo-, methyl ester

AG002SB4

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CAS Number	26218-78-0
Catalog Number	AG002SB4(AGN-PC-00M6G4)
Chemical Name	3-Pyridinecarboxylic acid, 6-bromo-, methyl ester
IUPAC Name	methyl 6-bromopyridine-3-carboxylate
InChI	InChI=1S/C7H6BrNO2/c1-11-7(10)5-2-3-6(8)9-4-5/h2-4H,1H3
InChI Key	NFLROFLPSNZIAH-UHFFFAOYSA-N
MDL Number	MFCD04972371
Molecular Formula	C7H6BrNO2
Molecular Weight	216.0320
SMILES	C1=NC(=CC=C1C(=O)OC)Br
Synonyms	Methyl 6-bromonicotinate, 26218-78-0, 6-Bromonicotinic acid methyl ester, methyl 6-bromopyridine-3-carboxylate, methyl 6-bromo-nicotinate, 3-Pyridinecarboxylic acid, 6-bromo-, methyl ester, 6-bromopyridine-3-carboxylic acid methyl ester, Methyl 2-bromopyridine-5-carboxylate, 2-bromo-5-nicotinic acid methyl ester, 6-bromo-nicotinic acid methyl ester, 6-bromo-pyridine-3-carboxylic acid methyl ester, MFCD04972371, 6-Bromonicotinicacidmethylester, PubChem14326, ACMC-209gpt, KSC497E4D, SCHEMBL424411, CTK3J7241, DTXSID10537837, NFLROFLPSNZIAH-UHFFFAOYSA-N, KS-000002RC, ZINC2539912, ANW-25935, BBL101615, CM-620, SBB053855, STL555411, Methyl 6-bromonicotinate, AldrichCPR, AKOS005256292, AC-5410, AN-1987, CS-W003208, Methyl 2-bromo-5-pyridinecarboxylicate, PB29326, PS-6227, QC-1730, RP09041, RTC-010889, AJ-38932, AK-27762, BC003844, BC219205, BR-27762, CJ-09180, N156, SC-35255, SY009097, AB0015584, AB1005103, DB-027653, ST1261414, TC-010889, 4CH-009806, A5208, AM20051009, FT-0083010, FT-0648084, M2682, MFCD04972371 (98%), 2-bromopyridine-5-carboxylic acid methyl ester, A-2216, 218M780, I02-1652, J-400986, F8884-2180, 6-Bromonicontinic acid methyl ester; Methyl 6-bromonicotinate; 6-Bromonicotinic acid ethyl ester; Methyl 6-bromopyridine-3-carboxylate, Methyl 2-bromopyridine-5-carboxylate; 6-Bromo-3-pyridinecarboxylic acid methyl ester, Methyl6-bromonicotinate, Methyl-6-bromonictinate, C7H6BrNO2, 6-BROMONICOTINIC ACID ETHYL, ethyl 6-bromopyridine-3-carboxylate, 6-BROMONICOTINIC ACID ETHYL ESTER, ETHYL 2-BROMO-5-PYRIDINECARBOXYLATE, 2-BROMO-5-PYRIDINECARBOXYLIC ACID ETHYL ESTER,

Complexity	151
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	214.958g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	216.034g/mol
Monoisotopic Mass	214.958g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.7

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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