AG003318

5398-44-7 | 2,6-Dichloroisonicotinic acid

AG003318

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CAS Number	5398-44-7
Catalog Number	AG003318(AGN-PC-0JM0WL)
Chemical Name	2,6-Dichloroisonicotinic acid
IUPAC Name	2,6-dichloropyridine-4-carboxylic acid
InChI	InChI=1S/C6H3Cl2NO2/c7-4-1-3(6(10)11)2-5(8)9-4/h1-2H,(H,10,11)
InChI Key	SQSYNRCXIZHKAI-UHFFFAOYSA-N
MDL Number	MFCD00234147
Molecular Formula	C6H3Cl2NO2
Molecular Weight	191.9995
NSC Number	4466
SMILES	O=C(O)c1cc(nc(c1)Cl)Cl
Synonyms	2,6-dichloroisonicotinic acid, 2,6-dichloroisonicotinic acid, calcium salt, 2,6-dichloroisonicotinic acid, lithium salt, 2,6-dichloroisonicotinic acid, magnesium salt, 2,6-dichloroisonicotinic acid, potassium salt, 2,6-dichloroisonicotinic acid, sodium salt, 2,6-Dichloroisonicotinic acid, 5398-44-7, 2,6-Dichloropyridine-4-carboxylic acid, 2,6-Dichloro-isonicotinic acid, 2,6-Dichloro-4-pyridinecarboxylic acid, 4-Pyridinecarboxylic acid, 2,6-dichloro-, MFCD00234147, CHEBI:73179, SQSYNRCXIZHKAI-UHFFFAOYSA-N, Pyridine-4-carboxylic acid, 2,6-dichloro-, 2,6-dichlorisonicotins, Enamine_005327, 2,6-Dichloroisonicotinicacid, zlchem 403, PubChem9235, ACMC-209lbt, AI3-19387, AC1L3SZX, AC1Q1GOV, SCHEMBL56204, KSC273S6B, TPC-PY019, 2,6-dichloroisonicotinoic acid, CHEMBL2447891, CTK1H3960, KS-00000KAG, 2,6-Dichloroisonicotinic acid #, DTXSID20202286, NSC4466, ZLC0257, HMS1409C03, WT650, ZINC163244, ACT02421, ALBB-006233, NSC-4466, ANW-31911, BBL104410, CD-574, SBB003621, STK503779, AKOS000271120, AB05154, AC-1716, CS-W007536, MCULE-5184216759, PS-3149, RP03817, RTC-063895, TRA0039466, SRI-4127-04, 2,6-dichloro-4-pyridine carboxylic acid, 4-Pyridinecarboxylicacid, 2,6-dichloro-, NCGC00339059-01, AJ-16001, AK-29357, AN-14643, BC207976, BR-29357, EN003033, S318, SC-05184, SY012339, AB0003857, AB1002692, DB-020179, ST2415920, TC-063895, TL8003540, 5398-44-7 2,6-dichloroisonicotinic acid, D3345, FT-0610616, Pyridine-4-carboxilic acid, 2, 6-dichloro-, ST50817472, MFCD00234147 (97%), 2,6-Dichloropyridine-4-carboxylic acid, 98%, A-2159, D67445, 398D447, AC-907/25004488, I02-0483, J-400214, Z56899064, F8880-0154, InChI=1/C6H3Cl2NO2/c7-4-1-3(6(10)11)2-5(8)9-4/h1-2H,(H,10,11, JKP, C6H3Cl2NO2, C6-H3-Cl2-N-O2, CID94830, AR-1D4801, A7843, C2836, 2,6-Dichloroisonicotinic acid, 98% - 1G 1g, INA, 55308-60-6,

Complexity	155
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	190.954g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	191.995g/mol
Monoisotopic Mass	190.954g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

Lot Number