1-Bromotridecane

C13H27BrCAS 765-09-3263.26 g/mol

Open in Covalent MOL file
Br
Alkyl halide

Properties

Molecular formula
C13H27Br
Molar mass
263.26 g/mol
Exact mass
262.1296 Da
Melting point
6.2 °C
Boiling point
296 °C
logP
5.69Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
11

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 39 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
765-09-3
SMILES
CCCCCCCCCCCCCBr
InChIKey
BFDNZQUBFCYTIC-UHFFFAOYSA-N
InChI
InChI=1S/C13H27Br/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h2-13H2,1H3

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Names and synonyms

5 names
  • Tridecane, 1-bromo-
  • Tridecyl bromide
  • n-Tridecyl bromide
  • 1-Bromo-n-tridecane
  • NSC 87870

Work with 1-Bromotridecane

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-Bromoheptadecane3508-00-7100 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook