Propargyl bromide

C3H3BrCAS 106-96-7118.96 g/mol

Br
Alkyl halideAlkyne

Properties

Molecular formula
C3H3Br
Molar mass
118.96 g/mol
Exact mass
117.9418 Da
Density
1.579 g/mL (at 19 °C)
Melting point
107–108 °C
Boiling point
88–90 °C
Flash point
10 °C (closed cup)
logP
1.01Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Hazards

Danger
Flammable (GHS02)Corrosive (GHS05)Acute Toxic (GHS06)Irritant (GHS07)

Aggregated from 53 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, P501

Identifiers

CAS number
106-96-7
SMILES
C#CCBr
InChIKey
YORCIIVHUBAYBQ-UHFFFAOYSA-N
InChI
InChI=1S/C3H3Br/c1-2-3-4/h1H,3H2

Weigh it out

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

Names and synonyms

9 names
  • 1-Propyne, 3-bromo-
  • Propyne, 3-bromo-
  • 3-Bromo-1-propyne
  • 3-Bromopropyne
  • 2-Propynyl bromide
  • 1-Bromo-2-propyne
  • NSC 8801
  • 1-(Bromomethyl)acetylene
  • 3-Propargyl bromide

Work with Propargyl bromide

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Elsewhere