4-Morpholinoacetophenone

C12H15NO2CAS 39910-98-0205.26 g/mol

Open in Covalent MOL file
ONO
EtherKetoneTertiary amine

Properties

Molecular formula
C12H15NO2
Molar mass
205.26 g/mol
Exact mass
205.1103 Da
Melting point
95–96 °C
logP
1.73Crippen estimate
Polar surface area
29.5 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
39910-98-0
SMILES
CC(=O)c1ccc(N2CCOCC2)cc1
InChIKey
AKQWEDMTPCAESO-UHFFFAOYSA-N
InChI
InChI=1S/C12H15NO2/c1-10(14)11-2-4-12(5-3-11)13-6-8-15-9-7-13/h2-5H,6-9H2,1H3

Weigh it out

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

Names and synonyms

11 names
  • 4′-Morpholinoacetophenone
  • Ethanone, 1-[4-(4-morpholinyl)phenyl]-
  • Acetophenone, 4′-morpholino-
  • 1-[4-(4-Morpholinyl)phenyl]ethanone
  • N-(4-Acetylphenyl)morpholine
  • 4-(4-Morpholinyl)acetophenone
  • 4′-Morpholin-4-ylacetophenone
  • 1-(4-Morpholinophenyl)ethanone
  • 4-(4-Acetylphenyl)morpholine
  • 1-(4-Morpholinophenyl)ethan-1-one
  • 1-[4-(Morpholin-4-yl)phenyl]ethan-1-one

Work with 4-Morpholinoacetophenone

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

4'-Piperidinoacetophenone10342-85-570 % similar 1-[4-(4-Methyl-1-piperazinyl)phenyl]ethanone26586-55-066 % similar 1-(4-Acetylphenyl)piperazine51639-48-666 % similar 4'-Diethylaminoacetophenone5520-66-162 % similar 4-Morpholinobenzoic acid7470-38-461 % similar 4-Dimethylaminoacetophenone2124-31-453 % similar 1,4-Diacetylbenzene1009-61-652 % similar 4-Morpholinobenzaldehyde1204-86-049 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

N-Phenyl-isobutyloylacetamide124401-38-3 Methyl 4-pyrrolidin-1-ylbenzoate129414-26-2 Methyl 1-benzylazetidine-2-carboxylate18085-37-5 4-Piperidin-1-yl-benzoic acid22090-24-0 3,4-Diethoxybenzeneacetonitrile27472-21-5 N-Benzyl-L-proline31795-93-4 4-Phenyl-4-piperidinecarboxylic acid3627-45-0 N-Benzyl-3-pyrrolidinecarboxylic acid5731-18-0

Elsewhere

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