N-(2,4-Dimethoxyphenyl)-3-oxobutanamide
Properties
- Molecular formula
- C12H15NO4
- Molar mass
- 237.25 g/mol
- Exact mass
- 237.1001 Da
- Melting point
- 92–94 °C
- logP
- 2.27Crippen estimate
- Polar surface area
- 68.1 Ų
- H-bond donors / acceptors
- 1 / 4
- Rotatable bonds
- 5
Hazards
Warning
- H302 Harmful if swallowed50% of notifiers
- H312 Harmful in contact with skin50% of notifiers
- H315 Causes skin irritation50% of notifiers
- H319 Causes serious eye irritation50% of notifiers
- H332 Harmful if inhaled50% of notifiers
- H335 May cause respiratory irritation50% of notifiers
Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
16715-79-0SMILES
COc1ccc(N=C(O)CC(C)=O)c(OC)c1InChIKey
IQWUCASGTZCNKK-UHFFFAOYSA-NInChI
InChI=1S/C12H15NO4/c1-8(14)6-12(15)13-10-5-4-9(16-2)7-11(10)17-3/h4-5,7H,6H2,1-3H3,(H,13,15)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- Butanamide, N-(2,4-dimethoxyphenyl)-3-oxo-
- Acetoacetanilide, 2′,4′-dimethoxy-
- 2′,4′-Dimethoxyacetoacetanilide
- NSC 50633
Work with N-(2,4-Dimethoxyphenyl)-3-oxobutanamide
Similar compounds
N-(2,5-Dimethoxyphenyl)-3-oxobutanamide6375-27-581 % similar
Acetoacet-o-anisidide92-15-970 % similar
N-(4-Chloro-2,5-dimethoxyphenyl)-3-oxobutanamide4433-79-864 % similar
(2,4-Dimethoxyphenyl)acetone831-29-853 % similar
N-(2,4-Dimethylphenyl)-3-oxobutanamide97-36-952 % similar
N-(2-Chlorophenyl)-3-oxobutanamide93-70-951 % similar
2′-Methylacetoacetanilide93-68-549 % similar
N-(2,5-Dichlorophenyl)-3-oxobutanamide2044-72-648 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds