Tritriacontane

C₃₃H₆₈CAS 630-05-7464.91 g/mol

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Properties

Molecular formula: C₃₃H₆₈
Molar mass: 464.91 g/mol
Exact mass: 464.5321 Da
Melting point: 72 °C
logP: 13.12Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 30

Identifiers

CAS number

630-05-7

SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC

InChIKey

SUJUOAZFECLBOA-UHFFFAOYSA-N

InChI

InChI=1S/C33H68/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-33H2,1-2H3

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Names and synonyms

1 names

n-Tritriacontane

Work with Tritriacontane

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

Decane124-18-5100 % similar Tetratriacontane14167-59-0100 % similar Heptane142-82-5100 % similar Tetracontane4181-95-7100 % similar Dotriacontane544-85-4100 % similar Octadecane593-45-3100 % similar Heptacosane593-49-7100 % similar Tridecane629-50-5100 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook