chempirical

Hexatriacontane

C36H74CAS 630-06-8506.99 g/mol

Open in Covalent MOL file

Properties

Molecular formula
C36H74
Molar mass
506.99 g/mol
Exact mass
506.5791 Da
Density
0.78 g/mL
Melting point
76.5 °C
Boiling point
298.4 °C
logP
14.29Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
33

Hazards

Not classified as hazardous under GHS by 44 ECHA notifiers. Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
630-06-8
SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
InChIKey
YDLYQMBWCWFRAI-UHFFFAOYSA-N
InChI
InChI=1S/C36H74/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-36H2,1-2H3

Weigh it out

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

Names and synonyms

2 names
  • n-Hexatriacontane
  • NSC 407536

Work with Hexatriacontane

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