1,6-Dibromohexane

C₆H₁₂Br₂CAS 629-03-8243.97 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₁₂Br₂
Molar mass: 243.97 g/mol
Exact mass: 241.9306 Da
Density: 1.6041 g/mL (at 20 °C)
Melting point: −2.3 °C
Boiling point: 245.5 °C
logP: 3.34Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 5

Identifiers

CAS number

629-03-8

SMILES

BrCCCCCCBr

InChIKey

SGRHVVLXEBNBDV-UHFFFAOYSA-N

InChI

InChI=1S/C6H12Br2/c7-5-3-1-2-4-6-8/h1-6H2

Weigh it out

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

Names and synonyms

5 names

Hexane, 1,6-dibromo-
1,6-Dibromo-n-hexane
Hexamethylene dibromide
α,ω-Dibromohexane
NSC 7306

Work with 1,6-Dibromohexane

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

1,5-Dibromopentane111-24-0100 % similar 1,11-Dibromoundecane16696-65-4100 % similar 1,12-Dibromododecane3344-70-5100 % similar 1,7-Dibromoheptane4549-31-9100 % similar 1,8-Dibromooctane4549-32-0100 % similar 1,9-Dibromononane4549-33-1100 % similar 1,4-Dibromobutane110-52-189 % similar 1,3-Dibromopropane109-64-870 % similar

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

Same formula

2,5-Dibromohexane24774-58-1 1,5-Dibromo-3-methylpentane4457-72-1

Elsewhere

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