Molecular properties
- Formula
- C7H14O2
- Molar mass
- 130.18 g·mol−1
- Exact mass
- 130.0994 Da
- 1
- 1
- 2
- 37.30 Ų
- 2.5 (PubChem computed XLogP3-AA descriptor)
- CAS
- 111-14-8
- PubChem CID
- 8094
Molecule record
Enanthic acid
C7H14O2
130.18 g/mol
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
| Property | Value | Conditions | Source |
|---|---|---|---|
| Logp | 2.5 | PubChem computed XLogP3-AA descriptor | PubChem(link only) |
Common names and synonyms
- 1-Hexanecarboxylic acid
- 111-14-8
- AI3-02073
- BRN 1744723
- CCRIS 6042
- DTXSID2021600
- EINECS 203-838-7
- Enanthylic acid
Show all 22 synonyms
- FEMA No. 3348
- HEPTANOIC ACID
- HSDB 5546
- Heptanoic acid (natural)
- Hepthlic acid
- Heptoic acid
- Hexacid C-7
- NSC 2192
- Oenanthic acid
- Oenanthylic acid
- THE3YNP39D
- UNII-THE3YNP39D
- n-Heptoic acid
- n-Heptylic acid
Structure identifiers
- Canonical SMILES
- CCCCCCC(=O)O
- Isomeric SMILES
- CCCCCCC(=O)O
- InChI
- InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)
- InChIKey
- MNWFXJYAOYHMED-UHFFFAOYSA-N
- PubChem CID
- 8094
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
Simulated FTIR trace
Predicted FTIR / %T
4 cm-1 resolution / deterministic instrument profile
Hover for cursor
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 Enanthic acid; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for Enanthic 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.