Ethyl2-methylquinoline-6-carboxylate

C₁₃H₁₃NO₂CAS 855763-77-8215.25 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₃H₁₃NO₂
Molar mass: 215.25 g/mol
Exact mass: 215.0946 Da
logP: 2.72Crippen estimate
Polar surface area: 39.2 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

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

855763-77-8

SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(C=C2)C

InChIKey

WLKKUWXLOSMSMH-UHFFFAOYSA-N

InChI

InChI=1S/C13H13NO2/c1-3-16-13(15)11-6-7-12-10(8-11)5-4-9(2)14-12/h4-8H,3H2,1-2H3

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Names and synonyms

1 names

Ethyl 2-methylquinoline-6-carboxylate

Work with Ethyl2-methylquinoline-6-carboxylate

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

Ethyl 2-naphthoate3007-91-860 % similar Ethyl 6-methylnicotinate21684-59-358 % similar 2-Methyl-6-quinolinecarboxylic acid635-80-357 % similar 6-Ethoxy-2-methylquinoline6628-28-055 % similar Diethyl terephthalate636-09-953 % similar Ethyl 3-methylbenzoate120-33-252 % similar Ethyl 2-chloro-6-benzothiazolecarboxylate78485-37-752 % similar 1,3-Diethyl 1,3-benzenedicarboxylate636-53-351 % similar

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

Same formula

Alpha-Amino-2-naphthalenepropanoic acid14108-60-2 4-(2,5-Dimethyl-1H-pyrrol-1-yl)benzoic acid15898-26-7 Dl-3-(1-naphthyl)alanine28095-56-9 L-1-Naphthylalanine55516-54-6 Ethyl 2-(quinolin-6-yl)acetate5622-38-8 2-Naphthylalanine58438-03-2 D-3-(2-Naphthyl)alanine76985-09-6 D-1-Naphthylalanine78306-92-0

Elsewhere

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