AG0090KG

1112851-50-9 | 5,6-Dimethoxypicolinonitrile

AG0090KG

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CAS Number	1112851-50-9
Catalog Number	AG0090KG(AGN-PC-0WANY9)
Chemical Name	5,6-Dimethoxypicolinonitrile
IUPAC Name	5,6-dimethoxypyridine-2-carbonitrile
InChI	InChI=1S/C8H8N2O2/c1-11-7-4-3-6(5-9)10-8(7)12-2/h3-4H,1-2H3
InChI Key	AORRFAWKKJICET-UHFFFAOYSA-N
MDL Number	MFCD11857661
Molecular Formula	C8H8N2O2
Molecular Weight	164.1613
SMILES	COC1=CC=C(C#N)N=C1OC
Synonyms	5,6-Dimethoxypicolinonitrile, 1112851-50-9, 5,6-dimethoxypyridine-2-carbonitrile, 6-CYANO-2,3-DIMETHOXY-PYRIDINE, SCHEMBL452416, 2,3-dimethoxy-6-cyanopyridine, AC1Q472D, CTK7B1970, DTXSID30673847, AORRFAWKKJICET-UHFFFAOYSA-N, 8782AC, FCH923287, MFCD11857661, ZINC35270403, AKOS006344800, QC-6475, RTR-057515, 5,6-Dimethoxypicolinonitrile, AldrichCPR, AK326272, TR-057515, CS-0089786, A-5954, C8H8N2O2,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	164.059g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	164.164g/mol
Monoisotopic Mass	164.059g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	55.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301
Packing Group	Ⅲ
Precautionary statements	P301+P310
UN Code	UN 2811

Certificate of Analysis

Lot Number