Heptanoic anhydride

C₁₄H₂₆O₃CAS 626-27-7242.36 g/mol

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Properties

Molecular formula: C₁₄H₂₆O₃
Molar mass: 242.36 g/mol
Exact mass: 242.1882 Da
Density: 0.9094 g/mL (at 30 °C)
Melting point: −12.4 °C
Boiling point: 269.5 °C
logP: 4.00Crippen estimate
Polar surface area: 43.4 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 10

Identifiers

CAS number

626-27-7

SMILES

CCCCCCC(=O)OC(=O)CCCCCC

InChIKey

DAPZDAPTZFJZTO-UHFFFAOYSA-N

InChI

InChI=1S/C14H26O3/c1-3-5-7-9-11-13(15)17-14(16)12-10-8-6-4-2/h3-12H2,1-2H3

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

Names and synonyms

6 names

Heptanoic acid, 1,1′-anhydride
Heptanoic acid, anhydride
Enanthic anhydride
Heptanoyl anhydride
n-Heptanoic acid anhydride
NSC 67902

Work with Heptanoic anhydride

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

Decanoic anhydride2082-76-0100 % similar Palmitic anhydride623-65-4100 % similar Stearic anhydride638-08-4100 % similar Valeric anhydride2082-59-982 % similar Oleic anhydride24909-72-681 % similar Dilauroyl peroxide105-74-875 % similar Methyl heptanoate106-73-069 % similar Methyl decanoate110-42-969 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook