AG008EPF

868636-76-4 | Ethyl 5-chloro-2-methylnicotinate

AG008EPF

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CAS Number	868636-76-4
Catalog Number	AG008EPF(AGN-PC-09SH9R)
Chemical Name	Ethyl 5-chloro-2-methylnicotinate
IUPAC Name	ethyl 5-chloro-2-methylpyridine-3-carboxylate
InChI	InChI=1S/C9H10ClNO2/c1-3-13-9(12)8-4-7(10)5-11-6(8)2/h4-5H,3H2,1-2H3
InChI Key	PTFXNMXWXUGGBH-UHFFFAOYSA-N
MDL Number	MFCD10698570
Molecular Formula	C9H10ClNO2
Molecular Weight	199.6342
SMILES	CCOC(=O)C1=C(C)N=CC(Cl)=C1
Synonyms	Ethyl 5-chloro-2-methylnicotinate, 868636-76-4, 5-Chloro-2-methyl-nicotinic acid ethyl ester, ETHYL 5-CHLORO-2-METHYLPYRIDINE-3-CARBOXYLATE, SCHEMBL3981366, CTK5F7284, KS-00000QVX, DTXSID80694244, PTFXNMXWXUGGBH-UHFFFAOYSA-N, 3662AC, ANW-69837, MFCD10698570, ZINC66319062, AKOS006303424, AB62423, DS-3642, QC-4641, AK100887, AJ-115861, TC-158582, ST24025001, 3-Pyridinecarboxylic acid, 5-chloro-2-methyl-, ethyl ester, C9H10ClNO2, Ethyl5-chloro-2-methylnicotinate,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	199.04g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	199.634g/mol
Monoisotopic Mass	199.04g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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