chempirical

Farnesol

C15H26OCAS 4602-84-0222.37 g/mol

Open in Covalent MOL file
OH
AlcoholAlkene

Properties

Molecular formula
C15H26O
Molar mass
222.37 g/mol
Exact mass
222.1984 Da
Density
0.8871 g/mL (at 20 °C)
Melting point
below 25 °C
Boiling point
110–113 °C
logP
4.40Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
7

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
4602-84-0
SMILES
CC(C)=CCCC(C)=CCCC(C)=CCO
InChIKey
CRDAMVZIKSXKFV-UHFFFAOYSA-N
InChI
InChI=1S/C15H26O/c1-13(2)7-5-8-14(3)9-6-10-15(4)11-12-16/h7,9,11,16H,5-6,8,10,12H2,1-4H3

Weigh it out

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

Names and synonyms

8 names
  • 2,6,10-Dodecatrien-1-ol, 3,7,11-trimethyl-
  • 3,7,11-Trimethyl-2,6,10-dodecatrien-1-ol
  • Farnesyl alcohol
  • FCI 119a
  • NSC 60597
  • Nikkosome
  • 3,7,11-Trimethyl-2,6,10-dodecen-1-ol
  • CSU 1806

Work with Farnesol

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Farnesol106-28-5Defined stereoisomer

Similar compounds

Solanesol13190-97-1100 % similar Geranylgeraniol24034-73-9100 % similar Geraniol106-24-196 % similar Nerol106-25-296 % similar Squalene111-02-472 % similar Squalene7683-64-972 % similar Farnesylacetone1117-52-858 % similar Geranylacetone3796-70-158 % similar

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

Same formula

Bisabolol23089-26-1 trans-Nerolidol40716-66-3 Beta-Eudesmol473-15-4 Guaiol489-86-1 Bisabolol515-69-5 Patchoulol5986-55-0 Nerolidol7212-44-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia