AG0035XJ

6274-82-4 | 2,6-Dimethoxyisonicotinic acid

AG0035XJ

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CAS Number	6274-82-4
Catalog Number	AG0035XJ(AGN-PC-0JOCAT)
Chemical Name	2,6-Dimethoxyisonicotinic acid
IUPAC Name	2,6-dimethoxypyridine-4-carboxylic acid
InChI	InChI=1S/C8H9NO4/c1-12-6-3-5(8(10)11)4-7(9-6)13-2/h3-4H,1-2H3,(H,10,11)
InChI Key	BLBZPNCBYHYDDP-UHFFFAOYSA-N
MDL Number	MFCD18257556
Molecular Formula	C8H9NO4
Molecular Weight	183.1614
NSC Number	37478
SMILES	COC=1C=C(C(=O)O)C=C(N1)OC
Synonyms	2,6-Dimethoxyisonicotinic acid, 6274-82-4, 2,6-dimethoxypyridine-4-carboxylic acid, 4-Pyridinecarboxylic acid, 2,6-dimethoxy-, BLBZPNCBYHYDDP-UHFFFAOYSA-N, 4-Pyridinecarboxylicacid,2,6-dimethoxy-, AC1Q5TSN, AC1L5V2T, SCHEMBL668838, 2,6-Dimethoxy-isonicotinic acid, CTK2F7376, KS-00000QLC, DTXSID30284497, NSC37478, ZINC1670053, ANW-67236, MFCD18257556, NSC-37478, AKOS016006730, AB74948, 4-Pyridinecarboxylicacid, 2,6-dimethoxy-, AJ-29149, AK-89514, TS-00218, TC-155981, W-4838, Z2692093563, 2,6-dimethoxyisonicotinicacid, AR-1D4940, CID235752, 4225-85-8, 67953-31-5,

Complexity	173
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	183.053g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	183.163g/mol
Monoisotopic Mass	183.053g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	68.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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