AG004A1K

886365-31-7 | 5-Bromo-2-chloroisonicotinic acid

AG004A1K

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CAS Number	886365-31-7
Catalog Number	AG004A1K(AGN-PC-02N79W)
Chemical Name	5-Bromo-2-chloroisonicotinic acid
IUPAC Name	5-bromo-2-chloropyridine-4-carboxylic acid
InChI	InChI=1S/C6H3BrClNO2/c7-4-2-9-5(8)1-3(4)6(10)11/h1-2H,(H,10,11)
InChI Key	YRPRNBZLQPBYDS-UHFFFAOYSA-N
MDL Number	MFCD07375114
Molecular Formula	C6H3BrClNO2
Molecular Weight	236.4505
SMILES	O=C(O)C1=C(Br)C=NC(Cl)=C1
Synonyms	5-Bromo-2-chloroisonicotinic acid, 886365-31-7, 5-Bromo-2-chloropyridine-4-carboxylic acid, 5-bromo-2-chloro-4-pyridinecarboxylic acid, 4-Pyridinecarboxylicacid, 5-bromo-2-chloro-, 5-bromo-2-chloroisonicotinic acid 97%, 4-Pyridinecarboxylic acid, 5-bromo-2-chloro-, 5-Bromo-2-chloroisonicotinicacid, ACMC-209qvd, KSC447O4J, SCHEMBL1998749, CTK3E7744, DTXSID90602890, EBD6779, YRPRNBZLQPBYDS-UHFFFAOYSA-N, 5-Bromo-2-chloro-isonicotinic acid, BCP09378, KS-00000CW9, ANW-39095, BBL103461, CL0356, MFCD07375114, SBB065387, STL557271, ZINC14982225, AKOS005145709, AM62375, CS-W004954, FE-0223, MCULE-1335065991, QC-7509, RP05729, RTR-027861, AJ-65600, AK-30394, AN-26583, SC-66013, SY024685, 2-chloro-5-bromopyridine-4-carboxylicacid, 2-Chloro-5-bromopyridine-4-carboxylic acid, 5-BROMO-2-CHLOROISONICOTINIC ACID?, AB0057338, DB-081723, ST2406101, TR-027861, 5-bromo-2-chloro-pyridine-4-carboxylic acid, FT-0648755, MFCD07375114 (97%), 5-Bromo-2-chloroisonicotinic acid, AldrichCPR, B-5232, 365B317, 5-bromanyl-2-chloranyl-pyridine-4-carboxylic acid, A842767, I02-0914, J-400293, ACN-056188, (5-Bromo-4-chloro-1H-indol-3-yl)butanoate, C2887, 6313-54-8,

Complexity	167
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	234.904g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	236.449g/mol
Monoisotopic Mass	234.904g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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