AG00ED46

5832-43-9 | 4-Methyl-5-nitro-2-pyridinecarboxylic acid

AG00ED46

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CAS Number	5832-43-9
Catalog Number	AG00ED46(AGN-PC-0OCPUZ)
Chemical Name	4-Methyl-5-nitro-2-pyridinecarboxylic acid
IUPAC Name	4-methyl-5-nitropyridine-2-carboxylic acid
InChI	InChI=1S/C7H6N2O4/c1-4-2-5(7(10)11)8-3-6(4)9(12)13/h2-3H,1H3,(H,10,11)
InChI Key	WRCSKWMCSRGUTG-UHFFFAOYSA-N
MDL Number	MFCD07368386
Molecular Formula	C7H6N2O4
Molecular Weight	182.1335
SMILES	C(=O)(O)c1cc(C)c(cn1)N(=O)=O
Synonyms	5832-43-9, 4-Methyl-5-nitropicolinic acid, 4-Methyl-5-nitro-2-pyridinecarboxylic acid, 4-methyl-5-nitropyridine-2-carboxylic acid, SCHEMBL5252542, CTK5A8157, DTXSID40496645, WRCSKWMCSRGUTG-UHFFFAOYSA-N, KS-00001AC8, FCH855209, MFCD07368386, RW1159, ZINC38540969, AKOS006287014, QC-3974, AJ-96565, AM804084, DS-12744, EN001643, SC-42537, AX8034170, DB-006871, TC-061528, 4-methyl-5-nitro-pyridine-2-carboxylic acid, CS-0035979, FT-0080277, FT-0650848, A831829, 4-METHYL-5-NITRO-2-PYRIDINECARBOXYLICACID,

Complexity	225
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	182.033g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	182.135g/mol
Monoisotopic Mass	182.033g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	96A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.9

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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