chempirical

2-Ethoxy-1-naphthalenecarboxaldehyde

C13H12O2CAS 19523-57-0200.24 g/mol

Open in Covalent MOL file
OO
AldehydeEther

Properties

Molecular formula
C13H12O2
Molar mass
200.24 g/mol
Exact mass
200.0837 Da
Melting point
115 °C
logP
3.05Crippen estimate
Polar surface area
26.3 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
3

Identifiers

CAS number
19523-57-0
SMILES
CCOc1ccc2ccccc2c1C=O
InChIKey
IMNKQTWVJHODOS-UHFFFAOYSA-N
InChI
InChI=1S/C13H12O2/c1-2-15-13-8-7-10-5-3-4-6-11(10)12(13)9-14/h3-9H,2H2,1H3

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

Names and synonyms

6 names
  • NSC 74560
  • 1-Naphthalenecarboxaldehyde, 2-ethoxy-
  • 1-Naphthaldehyde, 2-ethoxy-
  • 2-Ethoxynaphthaldehyde
  • 2-Ethoxy-1-naphthaldehyde
  • 2-Ethoxynaphthalene-1-carbaldehyde

Work with 2-Ethoxy-1-naphthalenecarboxaldehyde

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-Methoxy-1-naphthaldehyde5392-12-165 % similar 1-Ethoxynaphthalene5328-01-856 % similar 2-Ethoxybenzaldehyde613-69-453 % similar 2-Ethoxy-1-naphthalenecarboxylic acid2224-00-252 % similar 2-Ethoxy-1-naphthalenecarbonyl chloride55150-29-352 % similar 2-Hydroxy-1-naphthaldehyde708-06-550 % similar 3,4-Diethoxybenzaldehyde2029-94-948 % similar Anthracene-9-carbaldehyde642-31-947 % similar

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

Same formula

Monobenzone103-16-2 3-Phenoxybenzyl alcohol13826-35-2 2-[(1-Naphthalenyloxy)methyl]oxirane2461-42-9 Methyl 1-naphthylacetate2876-78-0 Ethyl 2-naphthoate3007-91-8 Ethyl 1-naphthalenecarboxylate3007-97-4 2-Acetyl-6-methoxynaphthalene3900-45-6 1-Acetoxy-2-methylnaphthalene5697-02-9

Elsewhere

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