AG00C48D

25635-17-0 | 2 -METHYLISONICOTINIC ACID ETHYL ESTER

AG00C48D

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CAS Number	25635-17-0
Catalog Number	AG00C48D(AGN-PC-0NI7OT)
Chemical Name	2 -METHYLISONICOTINIC ACID ETHYL ESTER
IUPAC Name	ethyl 2-methylpyridine-4-carboxylate
InChI	InChI=1S/C9H11NO2/c1-3-12-9(11)8-4-5-10-7(2)6-8/h4-6H,3H2,1-2H3
InChI Key	WOMYMRWGDVTGQI-UHFFFAOYSA-N
MDL Number	MFCD09746244
Molecular Formula	C9H11NO2
Molecular Weight	165.1891
SMILES	CCOC(=O)C1=CC(C)=NC=C1
Synonyms	Ethyl 2-methylisonicotinate, 25635-17-0, ethyl 2-methylpyridine-4-carboxylate, 2-Methylpyridine-4-carboxylic acid ethyl ester, 2 -METHYLISONICOTINIC ACID ETHYL ESTER, SCHEMBL363249, CTK4F6150, DTXSID10482095, WOMYMRWGDVTGQI-UHFFFAOYSA-N, 2111AB, ANW-54985, MFCD09746244, ZINC16697922, 2-methyl-isonicotinic acid ethyl ester, AKOS006280566, EG-0710, MCULE-3532462850, AJ-69435, AK-81009, SC-49841, DB-082591, TX-016495, CS-0061579, FT-0739838, Z-1825, 4-Pyridinecarboxylic acid, 2-methyl-, ethyl ester, C9H11NO2, ACN-S004668, 2-METHYLISONICOTINICACIDETHYLESTER, 65550-32-5,

Complexity	159
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	165.079g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	165.192g/mol
Monoisotopic Mass	165.079g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

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