1,13-Tetradecadiene

C₁₄H₂₆CAS 21964-49-8194.36 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₄H₂₆
Molar mass: 194.36 g/mol
Exact mass: 194.2035 Da
Density: 0.8486 g/mL (at 19 °C)
Boiling point: 129–133 °C (at 12 Torr)
logP: 5.26Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 11

Hazards

Warning

H315 Causes skin irritation97.5% of notifiers
H319 Causes serious eye irritation97.5% of notifiers
H335 May cause respiratory irritation97.5% of notifiers

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

21964-49-8

SMILES

C=CCCCCCCCCCCC=C

InChIKey

XMRSTLBCBDIKFI-UHFFFAOYSA-N

InChI

InChI=1S/C14H26/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3-4H,1-2,5-14H2

Weigh it out

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

Names and synonyms

1 names

Tetradeca-1,13-diene

Work with 1,13-Tetradecadiene

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

1,9-Decadiene1647-16-1100 % similar 1,8-Nonadiene4900-30-5100 % 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

1-Tetradecyne765-10-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook