5-Undecyne

C₁₁H₂₀CAS 2294-72-6152.28 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₁H₂₀
Molar mass: 152.28 g/mol
Exact mass: 152.1565 Da
logP: 3.76Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 5

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

2294-72-6

SMILES

CCCCCC#CCCCC

InChIKey

VRQLDBSWBBKOCR-UHFFFAOYSA-N

InChI

InChI=1S/C11H20/c1-3-5-7-9-11-10-8-6-4-2/h3-9H2,1-2H3

Weigh it out

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

Work with 5-Undecyne

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

5-Dodecyne19780-12-294 % similar 6-Dodecyne6975-99-193 % similar 5-Decyne1942-46-787 % similar 4-Decyne2384-86-382 % similar 4-Nonyne20184-91-276 % similar 3-Nonyne20184-89-874 % similar 3-Decyne2384-85-270 % similar Oct-3-yne15232-76-568 % similar

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

Same formula

1-Undecyne2243-98-3 3-Undecyne60212-30-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook