1,2-Cyclononadiene

C₉H₁₄CAS 1123-11-1122.21 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₉H₁₄
Molar mass: 122.21 g/mol
Exact mass: 122.1096 Da
logP: 3.05Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Identifiers

CAS number

1123-11-1

SMILES

C1CCCC=C=CCC1

InChIKey

YHGPUHUSTRYSIC-UHFFFAOYSA-N

InChI

InChI=1S/C9H14/c1-2-4-6-8-9-7-5-3-1/h1,5H,2,4,6-9H2

Weigh it out

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

Names and synonyms

2 names

Cyclonona-1,2-diene
[S,(-)]-1,2-Cyclononadiene

Work with 1,2-Cyclononadiene

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Cyclododecene1501-82-240 % similar Cycloheptene628-92-240 % similar cis-Cyclooctene931-87-340 % similar Cyclooctene931-88-440 % similar Cyclohexene110-83-833 % similar 1,9-Decadiene1647-16-133 % similar 1,13-Tetradecadiene21964-49-833 % similar 1,8-Nonadiene4900-30-533 % similar

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

Same formula

2-Propyn-1-ylcyclohexane17715-00-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook