N-(4-Acetylphenyl)acetamide

C₁₀H₁₁NO₂CAS 2719-21-3177.20 g/mol

Open in Covalent MOL file

Ketone

Properties

Molecular formula: C₁₀H₁₁NO₂
Molar mass: 177.20 g/mol
Exact mass: 177.0790 Da
Melting point: 171 °C
logP: 2.50Crippen estimate
Polar surface area: 49.7 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 2

Hazards

Warning

H315 Causes skin irritation13.6% of notifiers
H317 May cause an allergic skin reaction88.6% of notifiers
H319 Causes serious eye irritation13.6% of notifiers
H335 May cause respiratory irritation11.4% of notifiers

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

2719-21-3

SMILES

CC(=O)c1ccc(N=C(C)O)cc1

InChIKey

WECHHDJTILFYQT-UHFFFAOYSA-N

InChI

InChI=1S/C10H11NO2/c1-7(12)9-3-5-10(6-4-9)11-8(2)13/h3-6H,1-2H3,(H,11,13)

Weigh it out

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

Names and synonyms

12 names

Acetamide, N-(4-acetylphenyl)-
Acetanilide, 4′-acetyl-
4-Acetamidoacetophenone
4′-Acetylacetanilide
p-Acetamidoacetophenone
4′-Acetamidoacetophenone
p-Acetylaminoacetophenone
4′-(Acetylamino)acetophenone
4-(Acetylamino)phenyl methyl ketone
NSC 39449
p-Acetylacetanilide
N-(p-Acetylphenyl)acetamide

Work with N-(4-Acetylphenyl)acetamide

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

Acedoben556-08-168 % similar N,N'-Diacetyl-p-phenylenediamine140-50-165 % similar N-(3-Acetylphenyl)acetamide7463-31-265 % similar p-Chloroacetylacetanilide140-49-858 % similar 1,4-Diacetylbenzene1009-61-658 % similar 4′-Bromoacetanilide103-88-855 % similar 4-Methylacetanilide103-89-955 % similar Acetaminophen103-90-255 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Acetoacetanilide102-01-2 (R)-4-Benzyl-2-oxazolidinone102029-44-7 (3R)-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid103733-65-9 3,5-Dimethoxyphenylacetonitrile13388-75-5 1,3-Dihydro-4-(2-hydroxyethyl)-2H-indol-2-one139122-19-3 5,6-Dimethoxyindole14430-23-0 (4S,5R)-(-)-4-Methyl-5-phenyl-2-oxazolidinone16251-45-9 2,5-Dimethoxyphenylacetonitrile18086-24-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook