Methyl 2-Chloro-6-methoxyisonicotinate - CAS 42521-10-8

Catalog:	BB025150
Product Name:	Methyl 2-Chloro-6-methoxyisonicotinate
CAS:	42521-10-8
Synonyms:	2-chloro-6-methoxy-4-pyridinecarboxylic acid methyl ester; methyl 2-chloro-6-methoxypyridine-4-carboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	methyl 2-chloro-6-methoxypyridine-4-carboxylate
Description:	Methyl 2-Chloro-6-methoxyisonicotinate (CAS# 42521-10-8) is a useful research chemical.
Molecular Weight:	201.61
Molecular Formula:	C8H8ClNO3
Canonical SMILES:	COC1=NC(=CC(=C1)C(=O)OC)Cl
InChI:	InChI=1S/C8H8ClNO3/c1-12-7-4-5(8(11)13-2)3-6(9)10-7/h3-4H,1-2H3
InChI Key:	DAPAXVAUEVRBGS-UHFFFAOYSA-N
Boiling Point:	281.6 °C at 760 mmHg
Density:	1.288 g/cm³
Appearance:	White crystalline
MDL:	MFCD00173929
LogP:	1.53020

Publication Number	Title	Priority Date
CN-111825654-A	Phenylmethylene piperidine derivatives, preparation method, intermediates and uses thereof	20190419
WO-2020211836-A1	Benzene piperidine derivative, preparation method therefor, intermediate thereof and use thereof	20190419
EP-3548495-A1	Pyrazolopyrimidine derivatives as cam kinase inhibitors	20161130
TW-201831487-A	Fused heterocyclic compound as a CAM kinase inhibitor	20161130
TW-I651325-B	Fused heterocyclic compound as a CAM kinase inhibitor	20161130

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Complexity:	188
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	201.0192708
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	201.0192708
Rotatable Bond Count:	3
Topological Polar Surface Area:	48.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2