chempirical

5-Bromo-1-pentanol

C5H11BrOCAS 34626-51-2167.05 g/mol

Open in Covalent MOL file
HOBr
AlcoholAlkyl halide

Properties

Molecular formula
C5H11BrO
Molar mass
167.05 g/mol
Exact mass
165.9993 Da
Boiling point
72–74 °C (at 0.2 Torr)
logP
1.54Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
4

Identifiers

CAS number
34626-51-2
SMILES
OCCCCCBr
InChIKey
WJVQJXVMLRGNGA-UHFFFAOYSA-N
InChI
InChI=1S/C5H11BrO/c6-4-2-1-3-5-7/h7H,1-5H2

Weigh it out

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

Names and synonyms

3 names
  • 1-Pentanol, 5-bromo-
  • 5-Bromopentanol
  • 1-Bromo-5-hydroxypentane

Work with 5-Bromo-1-pentanol

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

7-Bromo-1-heptanol10160-24-4100 % similar 13-Bromo-1-tridecanol116754-58-6100 % similar 11-Bromo-1-undecanol1611-56-9100 % similar 12-Bromo-1-dodecanol3344-77-2100 % similar 6-Bromo-1-hexanol4286-55-9100 % similar 8-Bromo-1-octanol50816-19-8100 % similar 10-Bromo-1-decanol53463-68-6100 % similar 9-Bromononanol55362-80-6100 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook