chempirical

1-Bromoheptadecane

C17H35BrCAS 3508-00-7319.37 g/mol

Open in Covalent MOL file
Br
Alkyl halide

Properties

Molecular formula
C17H35Br
Molar mass
319.37 g/mol
Exact mass
318.1922 Da
Melting point
32 °C
Boiling point
349 °C
logP
7.25Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
15

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
3508-00-7
SMILES
CCCCCCCCCCCCCCCCCBr
InChIKey
HHSDZLLPIXMEIU-UHFFFAOYSA-N
InChI
InChI=1S/C17H35Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18/h2-17H2,1H3

Weigh it out

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

Names and synonyms

4 names
  • Heptadecane, 1-bromo-
  • n-Heptadecyl bromide
  • NSC 103682
  • Heptadecyl bromide

Work with 1-Bromoheptadecane

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-Bromohexane111-25-1100 % similar 1-Bromooctane111-83-1100 % similar 1-Bromodecane112-29-8100 % similar 1-Bromotetradecane112-71-0100 % similar 1-Bromohexadecane112-82-3100 % similar 1-Bromooctadecane112-89-0100 % similar 1-Bromododecane143-15-7100 % similar 1-Bromoeicosane4276-49-7100 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook