Enanthic acid

C7H14O2CAS 111-14-8130.19 g/mol

Open in Covalent MOL file
OOH
Carboxylic acid

Properties

Molecular formula
C7H14O2
Molar mass
130.19 g/mol
Exact mass
130.0994 Da
Density
0.9181 g/mL (at 20 °C)
Melting point
−7.5 °C
Boiling point
222.2 °C
pKa
4.4 (25 °C), 4.893 (25 °C)
Flash point
110 °C (closed cup)
Water solubility
2.42 g/L (15 °C)
logP
2.04Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
5

Hazards

Danger
Corrosive (GHS05)

Harmonised EU classification (CLP Annex VI, index 607-196-00-2), via PubChem.

Precautionary statements

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, P501

Identifiers

CAS number
111-14-8
SMILES
CCCCCCC(=O)O
InChIKey
MNWFXJYAOYHMED-UHFFFAOYSA-N
InChI
InChI=1S/C7H14O2/c1-2-3-4-5-6-7(8)9/h2-6H2,1H3,(H,8,9)

Weigh it out

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

Names and synonyms

12 names
  • Heptanoic acid
  • Enanthylic acid
  • n-Heptoic acid
  • Heptylic acid
  • 1-Hexanecarboxylic acid
  • n-Heptylic acid
  • Oenanthic acid
  • Oenanthylic acid
  • Heptoic acid
  • n-Heptanoic acid
  • NSC 2192
  • Enanthoic acid

Reactions

Work with Enanthic acid

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

Pentadecylic acid1002-84-2100 % similar Pelargonic acid112-05-0100 % similar Undecylic acid112-37-8100 % similar Behenic acid112-85-6100 % similar Caprylic acid124-07-2100 % similar Lauric acid143-07-7100 % similar Heneicosylic acid2363-71-5100 % similar Tricosylic acid2433-96-7100 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Propyl butyrate105-66-8 Methyl hexanoate106-70-7 4-Methoxy-4-methyl-2-pentanone107-70-0 Ethyl isovalerate108-64-5 2,2-Dimethylpentanoic acid1185-39-3 Isoamyl acetate123-92-2 tert-Butyl propionate20487-40-5 Methyl 2-methylpentanoate2177-77-7

Elsewhere

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