AG00CL77

339151-88-1 | Methyl 2-chloro-4,6-dimethylnicotinate

AG00CL77

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CAS Number	339151-88-1
Catalog Number	AG00CL77(AGN-PC-0WAN3N)
Chemical Name	Methyl 2-chloro-4,6-dimethylnicotinate
IUPAC Name	methyl 2-chloro-4,6-dimethylpyridine-3-carboxylate
InChI	InChI=1S/C9H10ClNO2/c1-5-4-6(2)11-8(10)7(5)9(12)13-3/h4H,1-3H3
InChI Key	JIWYJFSOPRWMOF-UHFFFAOYSA-N
MDL Number	MFCD18447630
Molecular Formula	C9H10ClNO2
Molecular Weight	199.6342
SMILES	COC(C1=C(Cl)N=C(C)C=C1C)=O
Synonyms	methyl 2-chloro-4,6-dimethylnicotinate, 339151-88-1, methyl 2-chloro-4,6-dimethylpyridine-3-carboxylate, KS-00000RPT, DTXSID00678965, MFCD18447630, ZINC68675287, AKOS006242952, DS-5824, AK137313, AJ-117148, ST2407147, 4CH-017017, AN-668/40771173, Methyl 2-chloro-4,6-dimethylnicotite, ACN-036503,

Complexity	198
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	2
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H319
Packing Group
Precautionary statements	P305+P351+P338
UN Code

Certificate of Analysis

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