N-(4-Ethoxyphenyl)-3-oxobutanamide
Properties
- Molecular formula
- C12H15NO3
- Molar mass
- 221.26 g/mol
- Exact mass
- 221.1052 Da
- Melting point
- 104–105 °C
- logP
- 2.00Crippen estimate
- Polar surface area
- 55.4 Ų
- H-bond donors / acceptors
- 1 / 3
- Rotatable bonds
- 5
Hazards
Danger
- H301 Toxic if swallowed33.3% of notifiers
- H302 Harmful if swallowed66.7% of notifiers
- H312 Harmful in contact with skin66.7% of notifiers
- H332 Harmful if inhaled66.7% of notifiers
Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, P405, P501
Identifiers
CAS number
122-82-7SMILES
CCOc1ccc(NC(=O)CC(C)=O)cc1InChIKey
WWROGCAUSKGAMX-UHFFFAOYSA-NInChI
InChI=1S/C12H15NO3/c1-3-16-11-6-4-10(5-7-11)13-12(15)8-9(2)14/h4-7H,3,8H2,1-2H3,(H,13,15)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- Butanamide, N-(4-ethoxyphenyl)-3-oxo-
- p-Acetoacetophenetidide
- Acetoacetic acid p-phenetidide
- 4′-Ethoxyacetoacetanilide
- NSC 50630
- 3-Oxo-N-(4′-ethoxyphenyl)butanamide
Work with N-(4-Ethoxyphenyl)-3-oxobutanamide
Similar compounds
N,N′-1,4-Phenylenebis[3-oxobutanamide]24731-73-571 % similar
N-(4-Methoxyphenyl)-3-oxobutanamide5437-98-969 % similar
N-(4-Methylphenyl)-3-oxobutanamide2415-85-262 % similar
N-(4-Chlorophenyl)-3-oxobutanamide101-92-860 % similar
1-(4-Ethoxyphenyl)ethanone1676-63-746 % similar
1,4-Diethoxybenzene122-95-244 % similar
4'-Ethoxy-3-hydroxy-2-naphthanilide4711-68-643 % similar
p-Ethoxybenzamide55836-71-043 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.