chempirical

Acetanilide

C8H9NOCAS 103-84-4135.17 g/mol

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Properties

Molecular formula
C8H9NO
Molar mass
135.17 g/mol
Exact mass
135.0684 Da
Density
1.219 g/mL (at 15 °C)
Melting point
114.3 °C
Boiling point
304 °C
pKa
0.5 (conjugate acid, 25 °C)
Flash point
169.4 °C (open cup)
Water solubility
< 1 g/L (22.2 °C)
logP
2.29Crippen estimate
Polar surface area
32.6 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 1,686 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
103-84-4
SMILES
CC(O)=Nc1ccccc1
InChIKey
FZERHIULMFGESH-UHFFFAOYSA-N
InChI
InChI=1S/C8H9NO/c1-7(10)9-8-5-3-2-4-6-8/h2-6H,1H3,(H,9,10)

Weigh it out

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Names and synonyms

16 names · show all
  • Acetamide, N-phenyl-
  • N-Phenylacetamide
  • Acetanil
  • Acetylaniline
  • Antifebrin
  • Benzenamine, N-acetyl-
  • Acetamidobenzene
  • Acetoanilide
  • N-Acetylaniline
  • Phenalgene
  • Phenalgin
  • N-Acetylaminobenzene
  • NSC 203231
  • NSC 7636
  • 1-Acetylaminobenzene
  • Anilino methyl ketone

Work with Acetanilide

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N,N'-Diacetyl-p-phenylenediamine140-50-176 % similar N-(3-Methylphenyl)acetamide537-92-864 % similar 4′-Bromoacetanilide103-88-862 % similar 4-Methylacetanilide103-89-962 % similar Acetaminophen103-90-262 % similar 4′-Mercaptoacetanilide1126-81-459 % similar 4-Aminoacetanilide122-80-559 % similar N-(4-Fluorophenyl)acetamide351-83-759 % similar

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

Same formula

Benzeneacetamide103-81-1 1,5,6,7-Tetrahydro-4H-indol-4-one13754-86-4 1-(3-Pyridyl)propan-1-one1570-48-5 4′-Methylformanilide3085-54-9 1-(6-Methyl-3-pyridinyl)ethanone36357-38-7 2,3-Dihydro-1-benzofuran-5-amine42933-43-7 o-Toluamide527-85-5 2'-Aminoacetophenone551-93-9

Elsewhere

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