Methyl 6-Methoxynicotinate - CAS 26218-80-4

Catalog:	BB019202
Product Name:	Methyl 6-Methoxynicotinate
CAS:	26218-80-4
Synonyms:	6-methoxy-3-pyridinecarboxylic acid methyl ester; methyl 6-methoxypyridine-3-carboxylate

Technical Data

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Computed Properties

IUPAC Name:	methyl 6-methoxypyridine-3-carboxylate
Description:	Methyl 6-Methoxynicotinate (CAS# 26218-80-4) is a useful research chemical.
Molecular Weight:	167.16
Molecular Formula:	C8H9NO3
Canonical SMILES:	COC1=NC=C(C=C1)C(=O)OC
InChI:	InChI=1S/C8H9NO3/c1-11-7-4-3-6(5-9-7)8(10)12-2/h3-5H,1-2H3
InChI Key:	OVLDWZNVBDRZNN-UHFFFAOYSA-N
Boiling Point:	237.9 °C at 760 mmHg
Density:	1.156 g/cm³
MDL:	MFCD00674130
LogP:	0.87680

Publication Number	Title	Priority Date
CN-112390744-A	Synthesis method of 6-methoxypyridine-3-methyl formate	20201202
WO-2021090030-A1	Gpr52 modulator compounds	20191108
WO-2020228756-A1	Inhibitor containing bicyclic derivative, preparation method therefor and use thereof	20190514
CN-112368283-A	Bicyclic derivative-containing inhibitor, preparation method and application thereof	20190514
WO-2020114388-A1	Substituted pyrazolo[1,5-a]pyridine compound, composition containing the same and use thereof	20181206

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Carbonyl Compounds

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[1035840-45-9]
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[59855-96-8]
2-(Methoxymethyl)thiazole-5-carboxylic Acid

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	160
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	167.058243149
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	167.058243149
Rotatable Bond Count:	3
Topological Polar Surface Area:	48.4 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1