3-(9-Anthracenyl)-2-propenal

C₁₇H₁₂OCAS 38982-12-6232.28 g/mol

Open in Covalent MOL file

Aldehyde Alkene

Properties

Molecular formula: C₁₇H₁₂O
Molar mass: 232.28 g/mol
Exact mass: 232.0888 Da
logP: 4.21Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 2

Identifiers

CAS number

38982-12-6

SMILES

O=CC=Cc1c2ccccc2cc2ccccc12

InChIKey

NLHDGEXLFCDTHQ-UHFFFAOYSA-N

InChI

InChI=1S/C17H12O/c18-11-5-10-17-15-8-3-1-6-13(15)12-14-7-2-4-9-16(14)17/h1-12H

Weigh it out

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

Names and synonyms

4 names

2-Propenal, 3-(9-anthracenyl)-
9-Anthraceneacrolein
9-Anthracenacrolein
3-(9-Anthryl)acrolein

Work with 3-(9-Anthracenyl)-2-propenal

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

Anthracene-9-carbaldehyde642-31-961 % similar 9-Vinylanthracene2444-68-050 % similar Cinnamaldehyde104-55-248 % similar Cinnamaldehyde14371-10-948 % similar 9,9′-Bianthryl1055-23-844 % similar 9-Phenylanthracene602-55-143 % similar 9-Phenanthrenecarboxaldehyde4707-71-542 % similar 9-Bromoanthracene1564-64-340 % similar

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

Same formula

1-Pyrenemethanol24463-15-8 1-Methoxypyrene34246-96-3 1-Benzoylnaphthalene642-29-5 2-Benzoylnaphthalene644-13-3

Elsewhere

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