AG007D7Q

1104455-41-5 | Methyl 4-chloro-5-methylpicolinate

AG007D7Q

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CAS Number	1104455-41-5
Catalog Number	AG007D7Q(AGN-PC-0ACAK3)
Chemical Name	Methyl 4-chloro-5-methylpicolinate
IUPAC Name	methyl 4-chloro-5-methylpyridine-2-carboxylate
InChI	InChI=1S/C8H8ClNO2/c1-5-4-10-7(3-6(5)9)8(11)12-2/h3-4H,1-2H3
InChI Key	KSYLPGBLKZFIQN-UHFFFAOYSA-N
MDL Number	MFCD16987786
Molecular Formula	C8H8ClNO2
Molecular Weight	185.6076
SMILES	O=C(OC)C1=NC=C(C)C(Cl)=C1
Synonyms	Methyl 4-chloro-5-methylpicolinate, 1104455-41-5, methyl 4-chloro-5-methylpyridine-2-carboxylate, 4-chloro-5-methylpyridine-2-carboxylic acid methyl ester, AK-88624, SCHEMBL3936135, CTK8B4675, KS-00000PTP, DTXSID80716753, KSYLPGBLKZFIQN-UHFFFAOYSA-N, ANW-45861, MFCD16987786, ZINC77028595, AKOS005259397, DS-1867, FCH1121927, MP-1972, SC-52952, AB0034739, AJ-122452, AX8227258, TX-016982, 4CH-011559, ST24025359, X8939, Methyl 4-chloro-5-methyl-pyridine-2-carboxylate, C8H8ClNO2,

Complexity	174
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	185.024g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	185.607g/mol
Monoisotopic Mass	185.024g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	39.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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