chempirical

Heptadecane

C17H36CAS 629-78-7240.47 g/mol

Open in Covalent MOL file

Properties

Molecular formula
C17H36
Molar mass
240.47 g/mol
Exact mass
240.2817 Da
Density
0.7732 g/mL (at 30 °C)
Melting point
22 °C
Boiling point
302 °C
logP
6.88Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
14

Identifiers

CAS number
629-78-7
SMILES
CCCCCCCCCCCCCCCCC
InChIKey
NDJKXXJCMXVBJW-UHFFFAOYSA-N
InChI
InChI=1S/C17H36/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-17H2,1-2H3

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Names and synonyms

5 names
  • n-Heptadecane
  • NSC 172782
  • TS 7
  • Ecojour TS 7
  • PCM 17

Work with Heptadecane

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

Octane111-65-9100 % similar Nonane111-84-2100 % similar Dodecane112-40-3100 % similar Icosane112-95-8100 % similar Undecane1120-21-4100 % similar Decane124-18-5100 % similar Tetratriacontane14167-59-0100 % similar Heptane142-82-5100 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia