AG002Z3G

29681-44-5 | 3-Pyridinecarboxylic acid, 5-bromo-, methyl ester

AG002Z3G

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CAS Number	29681-44-5
Catalog Number	AG002Z3G(AGN-PC-0JV46A)
Chemical Name	3-Pyridinecarboxylic acid, 5-bromo-, methyl ester
IUPAC Name	methyl 5-bromopyridine-3-carboxylate
InChI	InChI=1S/C7H6BrNO2/c1-11-7(10)5-2-6(8)4-9-3-5/h2-4H,1H3
InChI Key	AAJZXPWBILCHAW-UHFFFAOYSA-N
MDL Number	MFCD00173668
Molecular Formula	C7H6BrNO2
Molecular Weight	216.0320
SMILES	BrC=1C=NC=C(C(=O)OC)C1
Synonyms	Methyl 5-bromonicotinate, 29681-44-5, Methyl 5-bromopyridine-3-carboxylate, 5-Bromonicotinic acid methyl ester, 5-bromo nicotinic acid methyl ester, 5-Bromo-3-pyridinecarboxylic Acid Methyl Ester, 3-PYRIDINECARBOXYLIC ACID, 5-BROMO-, METHYL ESTER, MFCD00173668, 5-Bromopyridine-3-carboxylic acid methyl ester, 5-bromo-nicotinic acid methyl ester, 3-Bromo-5-(methoxycarbonyl)pyridine, Methyl 5-Bromo-3-pyridinecarboxylate, METHYL 3-BROMO-5-PYRIDINECARBOXYLATE, 5-bromo-3-pyridine carboxylic acid methyl ester, methyl-5-bromnicotinat, METHYL5-BROMONICOTINATE, PubChem22051, ACMC-209hai, methyl-5-bromonicotinate, Maybridge3_004992, AC1LF8K8, AC1Q42ZD, AC1Q43VG, KSC497E5F, SCHEMBL309752, AMPD00128, CTK3J7252, KS-00000BEC, ZINC77849, DTXSID70351394, 3-Bromo-5-methoxycarbonylpyridine, AAJZXPWBILCHAW-UHFFFAOYSA-N, BUTTPARK 37\04-20, HMS1445C20, ACN-S004164, ACT02451, ALBB-019944, Methyl5-Bromopyridine-3-carboxylate, STR08069, ANW-26680, methyl-5-bromopyridine-3-carboxylate, QC-434, RB1030, SBB065286, AKOS000265039, methyl-5-bromo-pyridine-3-carboxylate, AC-7244, AN-9193, CCG-251767, CS-W007467, LS20201, MCULE-6877889977, MS-3710, PB10112, RP04990, RTC-060448, TRA0014410, IDI1_016379, AJ-10419, AK-25229, BC004712, BC207471, BR-25229, CJ-00605, SC-25556, SY005317, ZB002764, AB0009436, AB1000428, DB-013121, Methyl 5-bromopyridine-3-carboxylate, 97%, TC-060448, AM20051048, FT-0628848, M2008, ST24033260, ST50307822, MFCD00173668 (98%), 3-bromo-5-pyridinecarboxylic acid methyl ester, M-2007, I02-0626, Q-101238, 5-Bromonicotinic acid methyl ester; 5-Bromopyridine-3-carboxylic acid methyl ester; Methyl 5-bromonicotinate, Ethyl-5-bromnicotinat, C7H6BrNO2, 5-Bromonicotinicacidmethylester, AR-1J6645, CID699336, ZINC00077849, ACN-029632, Methyl 5-bromopyridine-3-carboxylate, 98% - 1G 1g, 29871-12-3,

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	1.4

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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