chempirical

Cyclohexylammonium bromide

C6H14BrNCAS 26227-54-3180.09 g/mol

Open in Covalent MOL file
HBrH2N
Primary amine

Properties

Molecular formula
C6H14BrN
Molar mass
180.09 g/mol
Exact mass
179.0310 Da
Melting point
196–197 °C
logP
1.86Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
26227-54-3
SMILES
Br.NC1CCCCC1
InChIKey
QOHWJRRXQPGIQW-UHFFFAOYSA-N
InChI
InChI=1S/C6H13N.BrH/c7-6-4-2-1-3-5-6;/h6H,1-5,7H2;1H

Weigh it out

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

Names and synonyms

4 names
  • Cyclohexanamine, hydrobromide (1:1)
  • Cyclohexylamine, hydrobromide
  • Cyclohexanamine, hydrobromide
  • NSC 613661

Work with Cyclohexylammonium bromide

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

Cyclohexylamine108-91-880 % similar Cyclododecanamine1502-03-080 % similar Cycloheptylamine5452-35-780 % similar Cyclooctylamine5452-37-980 % similar Cyclopentylamine1003-03-873 % similar Cyclohexylammonium chloride4998-76-967 % similar Cyclobutylammonium chloride6291-01-653 % similar trans-1,4-Diaminocyclohexane2615-25-050 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook