chempirical

6-Bromo-1-hexene

C6H11BrCAS 2695-47-8163.06 g/mol

Open in Covalent MOL file
Br
AlkeneAlkyl halide

Properties

Molecular formula
C6H11Br
Molar mass
163.06 g/mol
Exact mass
162.0044 Da
Density
1.2169 g/mL (at 20 °C)
Boiling point
151 °C (at 712 Torr)
logP
2.74Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
4

Hazards

Warning
Flammable (GHS02)Irritant (GHS07)

Aggregated from 53 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number
2695-47-8
SMILES
C=CCCCCBr
InChIKey
RIMXEJYJXDBLIE-UHFFFAOYSA-N
InChI
InChI=1S/C6H11Br/c1-2-3-4-5-6-7/h2H,1,3-6H2

Weigh it out

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

Names and synonyms

5 names
  • 1-Hexene, 6-bromo-
  • 1-Bromo-5-hexene
  • 5-Hexenyl bromide
  • 6-Bromohexene
  • 5-Hexen-1-yl bromide

Work with 6-Bromo-1-hexene

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

8-Bromooct-1-ene2695-48-994 % similar 7-Bromo-1-heptene4117-09-394 % similar 10-Bromo-1-decene62871-09-494 % similar 11-Bromo-1-undecene7766-50-994 % similar 9-Bromo-1-nonene89359-54-694 % similar 5-Bromo-1-pentene1119-51-383 % similar 1,7-Octadiene3710-30-365 % similar 4-Bromo-1-butene5162-44-763 % similar

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

Same formula

Bromocyclohexane108-85-0 (Bromomethyl)cyclopentane3814-30-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook