chempirical

1-Bromopentadecane

C15H31BrCAS 629-72-1291.32 g/mol

Open in Covalent MOL file
Br
Alkyl halide

Properties

Molecular formula
C15H31Br
Molar mass
291.32 g/mol
Exact mass
290.1609 Da
Melting point
19 °C
Boiling point
322 °C
logP
6.47Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
13

Identifiers

CAS number
629-72-1
SMILES
CCCCCCCCCCCCCCCBr
InChIKey
JKOTZBXSNOGCIF-UHFFFAOYSA-N
InChI
InChI=1S/C15H31Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16/h2-15H2,1H3

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

Names and synonyms

4 names
  • Pentadecane, 1-bromo-
  • Pentadecyl bromide
  • n-Pentadecyl bromide
  • NSC 133440

Work with 1-Bromopentadecane

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-Bromoheptadecane3508-00-7100 % similar 1-Bromoeicosane4276-49-7100 % similar 1-Bromoheptane629-04-9100 % similar 1-Bromononane693-58-3100 % similar 1-Bromoundecane693-67-4100 % similar 1-Bromodocosane6938-66-5100 % similar 1-Bromotridecane765-09-3100 % similar 1-Bromobutane109-65-975 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook