Methyl heptanoate
Properties
- Molecular formula
- C8H16O2
- Molar mass
- 144.21 g/mol
- Exact mass
- 144.1150 Da
- Density
- 0.8788 g/mL (at 20 °C)
- Melting point
- −56 °C
- Boiling point
- 174 °C
- logP
- 2.13Crippen estimate
- Polar surface area
- 26.3 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 5
Identifiers
CAS number
106-73-0SMILES
CCCCCCC(=O)OCInChIKey
XNCNNDVCAUWAIT-UHFFFAOYSA-NInChI
InChI=1S/C8H16O2/c1-3-4-5-6-7-8(9)10-2/h3-7H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
8 names
- Heptanoic acid, methyl ester
- Methyl enanthate
- Methyl heptoate
- Methyl n-heptylate
- Methyl oenanthylate
- Methyl n-heptanoate
- Radia 30159
- Enanthic methyl ester
Work with Methyl heptanoate
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
Methyl decanoate110-42-9100 % similar
Methyl octanoate111-11-5100 % similar
Methyl laurate111-82-0100 % similar
Methyl palmitate112-39-0100 % similar
Methyl stearate112-61-8100 % similar
Methyl eicosanoate1120-28-1100 % similar
Methyl nonanoate1731-84-6100 % similar
Methyl undecanoate1731-86-8100 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds