1,2-Dibromocyclohexane

C6H10Br2CAS 5401-62-7241.95 g/mol

Open in Covalent MOL file
BrBr
Alkyl halide

Properties

Molecular formula
C6H10Br2
Molar mass
241.95 g/mol
Exact mass
239.9149 Da
logP
3.09Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
5401-62-7
SMILES
C1CCC(C(C1)Br)Br
InChIKey
CZNHKZKWKJNOTE-UHFFFAOYSA-N
InChI
InChI=1S/C6H10Br2/c7-5-3-1-2-4-6(5)8/h5-6H,1-4H2

Weigh it out

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

Names and synonyms

8 names
  • Cyclohexane, 1,2-dibromo-
  • 1,2-Dibromo-cyclohexane
  • (+/-)-trans-1,2-Dibromocyclohexane
  • 1,2-Bis(bromanyl)cyclohexane
  • 1,2-Dibromoc
  • 12-Dibromocyclohexane
  • Cyclohexane,2-dibromo-
  • Cyclohexane,1,2-dibromo-

Reactions

Work with 1,2-Dibromocyclohexane

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

trans-1,2-Dibromocyclohexane7429-37-0Defined stereoisomer

Similar compounds

Hexabromocyclododecane3194-55-667 % similar Bromocyclopentane137-43-947 % similar Bromocyclohexane108-85-044 % similar Bromocyclooctane1556-09-844 % similar Bromocycloheptane2404-35-544 % similar 1-Bromo-2-(bromodifluoromethyl)cyclohexane14737-09-843 % similar 1,2,3,4-Tetrabromobutane1529-68-638 % similar Bromocyclobutane4399-47-738 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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