AG008A5P

88912-27-0 | 3-Chloroisonicotinic acid

AG008A5P

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CAS Number	88912-27-0
Catalog Number	AG008A5P(AGN-PC-0KK7DC)
Chemical Name	3-Chloroisonicotinic acid
IUPAC Name	3-chloropyridine-4-carboxylic acid
InChI	InChI=1S/C6H4ClNO2/c7-5-3-8-2-1-4(5)6(9)10/h1-3H,(H,9,10)
InChI Key	MYAZXWFEMDJTFE-UHFFFAOYSA-N
MDL Number	MFCD09033519
Molecular Formula	C6H4ClNO2
Molecular Weight	157.5545
SMILES	ClC1=C(C(=O)O)C=CN=C1
Synonyms	3-chloroisonicotinic acid, 88912-27-0, 3-Chloropyridine-4-carboxylic acid, 3-Chloro-4-pyridinecarboxylic acid, 4-Pyridinecarboxylic acid, 3-chloro-, 3-Chloroisonicotinic acid, 97%, 88912-27-0 3-Chloroisonicotinic acid, 3-Chloro-4-pyridinecarboxylicacid, MFCD03094685, PubChem5087, ACMC-209qxw, 3-chloroisonicotinic cid, 3-chloro-isonicotinic acid, AC1MC46D, AC-907/34116064, KSC447S3L, SCHEMBL116912, 3-CHLOROISONICOTINICACID, CTK3E7935, KS-00000JQX, DTXSID70370964, MYAZXWFEMDJTFE-UHFFFAOYSA-N, ACN-S004231, ACT08980, ZINC2243484, 3-Chloropyridin-4-ylcarboxylic acid, 4-Pyridinecarboxylicacid, 3-chloro-, ANW-39186, CL0148, HT1071, SBB017604, WT1968, AKOS000112868, AB13346, AC-7512, AN-8929, CS-W003009, FS-2334, QC-1679, RP22136, RTR-027967, TRA0080145, AJ-34329, AK-26411, BR-26411, N313, SC-07188, SY007643, 3-Chloropyridine-4-carboxylic acid, 97%, AB0007679, AB1005158, DB-027632, ST2410650, TR-027967, 4CH-011722, AM20070263, FT-0646666, FT-0646667, C-1443, C67411, MFCD03094685 (97+%), 118754-EP2274983A1, 118754-EP2298747A1, 912C270, I02-0901, J-400351, 3-Chloro-4-pyridinecarboxylic acid; 3-Chloroisonicotinic acid, C6H4ClNO2, cc-427, 3-Chloropyridine-4-carboxylic acid 1g, ACN-031626, CID2735816, C2983, A10671,

Complexity	140
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	156.993g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	157.553g/mol
Monoisotopic Mass	156.993g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	50.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

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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