AG0038GP

73112-09-1 | 2-Cyanonicotinic acid

AG0038GP

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CAS Number	73112-09-1
Catalog Number	AG0038GP(AGN-PC-0NJBB1)
Chemical Name	2-Cyanonicotinic acid
IUPAC Name	2-cyanopyridine-3-carboxylic acid
InChI	InChI=1S/C7H4N2O2/c8-4-6-5(7(10)11)2-1-3-9-6/h1-3H,(H,10,11)
InChI Key	XKTPVUNCEFBYHP-UHFFFAOYSA-N
MDL Number	MFCD07368148
Molecular Formula	C7H4N2O2
Molecular Weight	148.1189
SMILES	C(#N)C1=C(C(=O)O)C=CC=N1
Synonyms	2-cyanonicotinic acid, 73112-09-1, 2-Cyanopyridine-3-carboxylic acid, 2-cyano-3-pyridinecarboxylic acid, AK-29479, 3-PYRIDINECARBOXYLIC ACID, 2-CYANO-, SCHEMBL1663588, CTK2H6955, DTXSID10501639, XKTPVUNCEFBYHP-UHFFFAOYSA-N, 3-Pyridinecarboxylicacid, 2-cyano-, 1354AC, ANW-59951, FCH855163, MFCD07368148, ZINC14684159, AKOS005264859, AB31804, QC-6485, AC-14844, AJ-65300, AS-50064, SC-49207, AX8074177, TC-148696, FT-0646510, J3.504.008K, EN300-133596, A837722, I02-0880, C7H4N2O2, 2-CYANOPYRIDINE-3-CARBOXYLICACID, 3-Pyridinecarboxylic acid, 2-cyano- (9CI),

Complexity	206
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	148.027g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	148.121g/mol
Monoisotopic Mass	148.027g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	74A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.4

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number