chempirical

1-Heptadecanol

C17H36OCAS 1454-85-9256.47 g/mol

Open in Covalent MOL file
OH
Alcohol

Properties

Molecular formula
C17H36O
Molar mass
256.47 g/mol
Exact mass
256.2766 Da
Melting point
53.8 °C
Boiling point
333 °C
logP
5.85Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
15

Identifiers

CAS number
1454-85-9
SMILES
CCCCCCCCCCCCCCCCCO
InChIKey
GOQYKNQRPGWPLP-UHFFFAOYSA-N
InChI
InChI=1S/C17H36O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18/h18H,2-17H2,1H3

Weigh it out

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

Names and synonyms

5 names
  • Heptadecyl alcohol
  • n-Heptadecanol
  • n-Heptadecyl alcohol
  • NSC 3921
  • Margaric alcohol

Work with 1-Heptadecanol

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

Similar compounds

1-Hexanol111-27-3100 % similar 1-Heptanol111-70-6100 % similar 1-Octanol111-87-5100 % similar 1-Decanol112-30-1100 % similar Undecanol112-42-5100 % similar Dodecanol112-53-8100 % similar 1-Tridecanol112-70-9100 % similar 1-Tetradecanol112-72-1100 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia