Methyl 2-methylnicotinate

C₈H₉NO₂CAS 65719-09-7151.16 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₉NO₂
Molar mass: 151.16 g/mol
Exact mass: 151.0633 Da
logP: 1.18Crippen estimate
Polar surface area: 39.2 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

65719-09-7

SMILES

CC1=C(C=CC=N1)C(=O)OC

InChIKey

KLHWBYHFWALOIJ-UHFFFAOYSA-N

InChI

InChI=1S/C8H9NO2/c1-6-7(8(10)11-2)4-3-5-9-6/h3-5H,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with Methyl 2-methylnicotinate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,3-Dimethyl 2,3-pyridinedicarboxylate605-38-968 % similar Ethyl 2-methyl-3-pyridinecarboxylate1721-26-265 % similar Methyl 2-aminopyridine-3-carboxylate14667-47-164 % similar Methyl 2-chloronicotinate40134-18-764 % similar 2-Fluoronicotinic acid methyl ester446-26-464 % similar Methyl 2-bromopyridine-3-carboxylate52718-95-364 % similar 2-Cyano-3-pyridinecarboxylic acid methyl ester75358-89-359 % similar Dimethyl phthalate131-11-358 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1-Ethyl-4-nitrobenzene100-12-9 N-Phenylglycine103-01-5 Acetaminophen103-90-2 4-(Methylamino)benzoic acid10541-83-0 N-Methylanthranilic acid119-68-6 4-Aminophenylacetic acid1197-55-3 2,6-Dimethyl-4-nitrosophenol13331-93-6 Methyl anthranilate134-20-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook