Molecule record

butyric acid

C4H8O2

88.11 g/mol

2D structure for butyric acid

Molecular properties

Formula
C4H8O2
Molar mass
88.11 g·mol−1
Exact mass
88.0524 Da
1
1
2
37.30 Ų
0.8 (PubChem computed XLogP3-AA descriptor)
CAS
107-92-6
PubChem CID
264

Interactions

Polarity
Often polar; exact polarity depends on size, substitution, and ionization state.
Acid-base behavior
Review ionizable groups and pKa data where available; ChemForge does not infer definitive acid-base state from identity alone.
Intermolecular forces
Assess dispersion, dipole interactions, hydrogen bonding, and ionic character from the functional groups shown.

Functional groups

Alcohol
Carboxylic acid

Physical properties

PropertyValueConditionsSource
Logp0.8PubChem computed XLogP3-AA descriptorPubChem(link only)

Common names and synonyms

  • 1-Butyric acid
  • 1-butanoic acid
  • 1-propanecarboxylic acid
  • 107-92-6
  • 40UIR9Q29H
  • Butanic acid
  • Buttersaeure
  • Butyricum acidum
Show all 23 synonyms
  • CHEBI:30772
  • DTXCID401515
  • DTXSID8021515
  • FEMA No. 2221
  • FEMA Number 2221
  • Kyselina maselna
  • NORMAL BUTYRIC ACID
  • NSC-8415
  • NSC8415
  • Propanecarboxylic acid
  • butanoic acid
  • ethylacetic acid
  • n-Butanoic acid
  • n-Butyric acid
  • propylformic acid

Structure identifiers

Canonical SMILES
CCCC(=O)O
Isomeric SMILES
CCCC(=O)O
InChI
InChI=1S/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6)
InChIKey
FERIUCNNQQJTOY-UHFFFAOYSA-N
PubChem CID
264

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library

Simulated FTIR trace

Predicted FTIR / %T

4 cm-1 resolution / deterministic instrument profile

Hover for cursor
4000350030002500200015001000500100500wavenumber (cm−1)transmittance (%)

Peak assignments

3350 cm−1broad O-H (simulated)
3000 cm−1broad acid O-H (simulated)
1710 cm−1C=O acid (simulated)
2960 cm−1sp3 C-H (simulated)

Simulated NMR

On-demand educational prediction for butyric acid; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for butyric acid; not experimental data.

Sources

Molecule identity

Retrieved 8/7/2026. Reuse status is summarized by the badge; open the source for full details.

simulated IR

ChemForge original educational simulation.

Open source record