trans-Chalcone

C₁₅H₁₂OCAS 614-47-1208.26 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₅H₁₂O
Molar mass: 208.26 g/mol
Exact mass: 208.0888 Da
Melting point: 59 °C
Boiling point: 218–222 °C (at 4 Torr)
logP: 3.58Crippen estimate
Polar surface area: 17.1 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 3
Double bonds: EE/Z, in SMILES order

Identifiers

CAS number

614-47-1

SMILES

O=C(/C=C/c1ccccc1)c1ccccc1

InChIKey

DQFBYFPFKXHELB-VAWYXSNFSA-N

InChI

InChI=1S/C15H12O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-12H/b12-11+

Weigh it out

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

Names and synonyms

20 names · show all

2-Propen-1-one, 1,3-diphenyl-, (2E)-
Chalcone, (E)-
2-Propen-1-one, 1,3-diphenyl-, (E)-
(2E)-1,3-Diphenyl-2-propen-1-one
trans-Benzalacetophenone
trans-1,3-Diphenylpropen-3-one
(E)-Chalcone
trans-Benzylideneacetophenone
(E)-1,3-Diphenylpropen-3-one
(E)-1-Benzoyl-2-phenylethylene
Phenyl trans-styryl ketone
(E)-Benzylideneacetophenone
trans-1,3-Diphenyl-2-propen-1-one
(E)-1,3-Diphenyl-2-propen-1-one
Phenyl (E)-2-phenylethenyl ketone
trans-1,3-Diphenylprop-1-en-3-one
(E)-1,3-Diphenylpropenone
NSC 167107
(E)-Benzalacetophenone
Phenyl (E)-styryl ketone

Work with trans-Chalcone

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

Same formula

Dibenzosuberone1210-35-1 9-Anthracenemethanol1468-95-7 (±)-3-Phenyl-1-indanone16618-72-7 1,1-Diphenyl-2-propyn-1-ol3923-52-2 2-Acetyl-9H-fluorene781-73-7 Chalcone94-41-7

Elsewhere

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