AG003Q2M

919354-52-2 | Ethyl 2,6-dichloro-5-cyanonicotinate

AG003Q2M

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CAS Number	919354-52-2
Catalog Number	AG003Q2M(AGN-PC-0JEEQK)
Chemical Name	Ethyl 2,6-dichloro-5-cyanonicotinate
IUPAC Name	ethyl 2,6-dichloro-5-cyanopyridine-3-carboxylate
InChI	InChI=1S/C9H6Cl2N2O2/c1-2-15-9(14)6-3-5(4-12)7(10)13-8(6)11/h3H,2H2,1H3
InChI Key	UDWGETXHCFVFDI-UHFFFAOYSA-N
MDL Number	MFCD22415252
Molecular Formula	C9H6Cl2N2O2
Molecular Weight	245.0621
SMILES	O=C(C1=CC(C#N)=C(Cl)N=C1Cl)OCC
Synonyms	ETHYL 2,6-DICHLORO-5-CYANONICOTINATE, 919354-52-2, ethyl 2,6-dichloro-5-cyanopyridine-3-carboxylate, 3-Pyridinecarboxylic acid, 2,6-dichloro-5-cyano-, ethyl ester, SCHEMBL4874531, CTK3H3624, DTXSID90843963, UDWGETXHCFVFDI-UHFFFAOYSA-N, KS-000004XM, ZX-RL002270, MFCD22415252, ZINC90464252, ethyl 5-cyano-2,6-dichloronicotinate, AKOS025146564, GH-0710, PB11791, TRA0042551, AK165329, CJ-22567, OR303340, SY020113, AB0055893, TC-308186, CS-0049518, Q-1727, MFCD22415252 (97+%), 19617-43-7,

Complexity	289
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	243.981g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	245.059g/mol
Monoisotopic Mass	243.981g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	63A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number