chempirical

Butyramide

C4H9NOCAS 541-35-587.12 g/mol

Open in Covalent MOL file
NH2O

Properties

Molecular formula
C4H9NO
Molar mass
87.12 g/mol
Exact mass
87.0684 Da
Density
0.885 g/mL (at 120 °C)
Melting point
115–116 °C
Boiling point
216 °C
pKa
-0.43 (conjugate acid)
Water solubility
163 g/L
logP
1.32Crippen estimate
Polar surface area
44.1 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
541-35-5
SMILES
CCCC(=N)O
InChIKey
DNSISZSEWVHGLH-UHFFFAOYSA-N
InChI
InChI=1S/C4H9NO/c1-2-3-4(5)6/h2-3H2,1H3,(H2,5,6)

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Names and synonyms

5 names
  • Butanamide
  • n-Butylamide
  • n-Butyramide
  • Butanimidic acid
  • NSC 8424

Work with Butyramide

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

Pentanamide626-97-171 % similar Hexanamide628-02-471 % similar Dodecanamide1120-16-768 % similar Stearamide124-26-568 % similar Behenamide3061-75-468 % similar Hexadecanamide629-54-968 % similar Tetradecanamide638-58-468 % similar Succinamide110-14-561 % similar

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

Same formula

(+)-3-Pyrrolidinol100243-39-8 (S)-3-Aminotetrahydrofuran104530-79-2 1-Aziridineethanol1072-52-2 Butyraldoxime110-69-0 Morpholine110-91-8 3-Methoxy-azetidine110925-17-2 (R)-3-Aminotetrahydrofuran111769-26-7 N-Methylpropionamide1187-58-2

Elsewhere

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