chempirical

4-Methylbenzamide

C8H9NOCAS 619-55-6135.17 g/mol

Open in Covalent MOL file
NH2O
Amide

Properties

Molecular formula
C8H9NO
Molar mass
135.17 g/mol
Exact mass
135.0684 Da
Melting point
161–163 °C
logP
1.09Crippen estimate
Polar surface area
43.1 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
619-55-6
SMILES
Cc1ccc(C(N)=O)cc1
InChIKey
UHBGYFCCKRAEHA-UHFFFAOYSA-N
InChI
InChI=1S/C8H9NO/c1-6-2-4-7(5-3-6)8(9)10/h2-5H,1H3,(H2,9,10)

Weigh it out

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

Names and synonyms

5 names
  • Benzamide, 4-methyl-
  • p-Toluamide
  • p-Methylbenzamide
  • p-Tolylamide
  • NSC 2163

Work with 4-Methylbenzamide

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

Terephthalamide3010-82-070 % similar 1,2-Bis(4-methylphenyl)-1,2-ethanedione3457-48-558 % similar 4,4′-Dimethylbenzophenone611-97-258 % similar 4-Aminobenzamide2835-68-956 % similar P-Methylacetophenone122-00-954 % similar 4-Chlorobenzamide619-56-754 % similar 4-Hydroxybenzamide619-57-854 % similar 4-Bromobenzamide698-67-954 % similar

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

Same formula

Benzeneacetamide103-81-1 Acetanilide103-84-4 1,5,6,7-Tetrahydro-4H-indol-4-one13754-86-4 3-Propionylpyridine1570-48-5 N-(4-Methylphenyl)formamide3085-54-9 1-(6-Methyl-3-pyridinyl)ethanone36357-38-7 2′-Aminoacetophenone551-93-9 2-Acetyl-4-methylpyridine59576-26-0

Elsewhere

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