(±)-Aegeline
Properties
- Molecular formula
- C18H19NO3
- Molar mass
- 297.35 g/mol
- Exact mass
- 297.1365 Da
- Melting point
- 178–179 °C
- logP
- 3.40Crippen estimate
- Polar surface area
- 62.0 Ų
- H-bond donors / acceptors
- 2 / 3
- Rotatable bonds
- 6
- Double bonds
- EE/Z, in SMILES order
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
456-12-2SMILES
COc1ccc(C(O)CN=C(O)/C=C/c2ccccc2)cc1InChIKey
QRFDENJATPJOKG-KPKJPENVNA-NInChI
InChI=1/C18H19NO3/c1-22-16-10-8-15(9-11-16)17(20)13-19-18(21)12-7-14-5-3-2-4-6-14/h2-12,17,20H,13H2,1H3,(H,19,21)/b12-7+Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
8 names
- 2-Propenamide, N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-phenyl-, (2E)-
- Egeline
- 2-Propenamide, N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-phenyl-, (E)-(±)-
- (2E)-N-[2-Hydroxy-2-(4-methoxyphenyl)ethyl]-3-phenyl-2-propenamide
- Aegelin
- Aegeline
- (±)-Egeline
- 2-Propenamide, N-[2-hydroxy-2-(4-methoxyphenyl)ethyl]-3-phenyl-, (E)-
Work with (±)-Aegeline
Similar compounds
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1-(4-Methoxyphenyl)-1-penten-3-one104-27-837 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds