1,8-Nonadiene

C₉H₁₆CAS 4900-30-5124.23 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₆
Molar mass: 124.23 g/mol
Exact mass: 124.1252 Da
Density: 0.8159 g/mL (at 21 °C)
Melting point: −21 °C
Boiling point: 142.5 °C
logP: 3.31Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 6

Identifiers

CAS number

4900-30-5

SMILES

C=CCCCCCC=C

InChIKey

VJHGSLHHMIELQD-UHFFFAOYSA-N

InChI

InChI=1S/C9H16/c1-3-5-7-9-8-6-4-2/h3-4H,1-2,5-9H2

Weigh it out

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

Work with 1,8-Nonadiene

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

1,9-Decadiene1647-16-1100 % similar 1,13-Tetradecadiene21964-49-8100 % similar 1,7-Octadiene3710-30-392 % similar 1,6-Heptadiene3070-53-977 % similar 1-Octene111-66-067 % similar 1-Dodecene112-41-467 % similar 10-Undecen-1-ol112-43-667 % similar 10-Undecenal112-45-867 % similar

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

Same formula

Allylcyclohexane2114-42-3 1-Nonyne3452-09-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook