chempirical

2-Nonyn-1-ol

C9H16OCAS 5921-73-3140.23 g/mol

Open in Covalent MOL file
OH
AlcoholAlkyne

Properties

Molecular formula
C9H16O
Molar mass
140.23 g/mol
Exact mass
140.1201 Da
Density
0.878 g/mL (at 16 °C)
Boiling point
109–111 °C (at 11 Torr)
logP
1.95Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
4

Identifiers

CAS number
5921-73-3
SMILES
CCCCCCC#CCO
InChIKey
XERDOEKKHDALKJ-UHFFFAOYSA-N
InChI
InChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h10H,2-6,9H2,1H3

Weigh it out

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

Names and synonyms

1 names
  • 1-Hydroxy-2-nonyne

Work with 2-Nonyn-1-ol

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

2-Octyn-1-ol20739-58-695 % similar 2-Heptyn-1-ol1002-36-482 % similar 5-Dodecyne19780-12-268 % similar 7-Hexadecyn-1-ol822-21-968 % similar 2-Hexyn-1-ol764-60-365 % similar 3-Nonyn-1-ol31333-13-864 % similar 5-Decyne1942-46-755 % similar 3-Octyn-1-ol14916-80-454 % similar

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

Same formula

Cyclohexylacetone103-78-6 (±)-2,6-Dimethyl-5-heptenal106-72-9 1-(2-Propen-1-yl)cyclohexanol1123-34-8 3-Nonen-2-one14309-57-0 2-Nonenal18829-56-6 3,6-Dimethyl-1-heptyn-3-ol19549-98-5 4-Methyl-1-octyn-4-ol22128-43-4 cis-6-Nonenal2277-19-2

Elsewhere

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