chempirical

Montanic acid

C28H56O2CAS 506-48-9424.75 g/mol

Open in Covalent MOL file
OOH
Carboxylic acid

Properties

Molecular formula
C28H56O2
Molar mass
424.75 g/mol
Exact mass
424.4280 Da
Melting point
90.9 °C
Boiling point
86–86.5 °C
logP
10.23Crippen estimate
Polar surface area
37.3 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
26

Hazards

Warning
Irritant (GHS07)

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P317, P330, P501

Identifiers

CAS number
506-48-9
SMILES
CCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O
InChIKey
UTOPWMOLSKOLTQ-UHFFFAOYSA-N
InChI
InChI=1S/C28H56O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28(29)30/h2-27H2,1H3,(H,29,30)

Weigh it out

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

Names and synonyms

6 names
  • n-Octacosanoic acid
  • Licowax S
  • NSC 407311
  • HW-SW
  • Licowax SFL
  • Octacosanoic acid

Work with Montanic acid

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

Enanthic acid111-14-8100 % similar Pelargonic acid112-05-0100 % similar Undecylic acid112-37-8100 % similar Behenic acid112-85-6100 % similar Caprylic acid124-07-2100 % similar Lauric acid143-07-7100 % similar Heneicosylic acid2363-71-5100 % similar Tricosylic acid2433-96-7100 % similar

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

Same formula

Myristyl myristate3234-85-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia