Cyclooctane

C₈H₁₆CAS 292-64-8112.22 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₁₆
Molar mass: 112.22 g/mol
Exact mass: 112.1252 Da
Density: 0.891 g/mL (at 20 °C)
Melting point: 14.8 °C
Boiling point: 149 °C
logP: 3.12Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Identifiers

CAS number

292-64-8

SMILES

C1CCCCCCC1

InChIKey

WJTCGQSWYFHTAC-UHFFFAOYSA-N

InChI

InChI=1S/C8H16/c1-2-4-6-8-7-5-3-1/h1-8H2

Weigh it out

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

Names and synonyms

1 names

NSC 72426

Work with Cyclooctane

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

Cyclohexane110-82-7100 % similar Cyclopentane287-92-3100 % similar Cycloheptane291-64-5100 % similar Cyclodecane293-96-9100 % similar Cyclododecane294-62-2100 % similar Cyclopentadecane295-48-7100 % similar Piperidine110-89-433 % similar 1,5-Dibromopentane111-24-033 % similar

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

Same formula

2,4,4-Trimethyl-1-pentene107-39-1 2,4,4-Trimethyl-2-pentene107-40-4 Isooctene11071-47-9 1-Octene111-66-0 2-Octene111-67-1 trans-2-Octene13389-42-9 trans-4-Octene14850-23-8 trans-3-Octene14919-01-8

Elsewhere

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