chempirical

1-Tridecanol

C13H28OCAS 112-70-9200.37 g/mol

Open in Covalent MOL file
OH
Alcohol

Properties

Molecular formula
C13H28O
Molar mass
200.37 g/mol
Exact mass
200.2140 Da
Density
0.8223 g/mL (at 31 °C)
Melting point
32.5 °C
Boiling point
152 °C (at 14 Torr)
logP
4.29Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
11

Identifiers

CAS number
112-70-9
SMILES
CCCCCCCCCCCCCO
InChIKey
XFRVVPUIAFSTFO-UHFFFAOYSA-N
InChI
InChI=1S/C13H28O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h14H,2-13H2,1H3

Weigh it out

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

Names and synonyms

5 names
  • Tridecyl alcohol
  • n-Tridecyl alcohol
  • n-Tridecanol
  • n-Tridecan-1-ol
  • NSC 5252

Work with 1-Tridecanol

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-Decanol112-30-1100 % similar Undecanol112-42-5100 % similar 1-Tetradecanol112-72-1100 % similar Stearyl alcohol112-92-5100 % similar 1-Nonanol143-08-8100 % similar 1-Nonadecanol1454-84-8100 % similar 1-Heptadecanol1454-85-9100 % similar 1-Heneicosanol15594-90-8100 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia