2,3-Dibromopropionitrile
Properties
- Molecular formula
- C3H3Br2N
- Molar mass
- 212.87 g/mol
- Exact mass
- 210.8632 Da
- Density
- 2.174 g/mL (at 20 °C)
- Melting point
- 131–132 °C
- Boiling point
- 106–107 °C (at 22 Torr)
- logP
- 1.67Crippen estimate
- Polar surface area
- 23.8 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Hazards
Warning
- H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled97.5% of notifiers
- H302 Harmful if swallowed97.5% of notifiers
- H312 Harmful in contact with skin97.5% of notifiers
- H315 Causes skin irritation97.5% of notifiers
- H319 Causes serious eye irritation97.5% of notifiers
- H332 Harmful if inhaled97.5% of notifiers
- H335 May cause respiratory irritation97.5% of notifiers
Aggregated from 40 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+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
4554-16-9SMILES
N#CC(Br)CBrInChIKey
ARRIEYYNOLTVTE-UHFFFAOYSA-NInChI
InChI=1S/C3H3Br2N/c4-1-3(5)2-6/h3H,1H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
5 names
- Propanenitrile, 2,3-dibromo-
- Propionitrile, 2,3-dibromo-
- 2,3-Dibromopropanenitrile
- α,β-Dibromopropionitrile
- 2,3-Dibromopropanonitrile
Work with 2,3-Dibromopropionitrile
Similar compounds
Dibromoacetonitrile3252-43-538 % similar
1,2,3,4-Tetrabromobutane1529-68-633 % similar
1,1,2-Tribromoethane78-74-033 % similar
1,2,3-Tribromopropane96-11-733 % similar
Cyclopropyl cyanide5500-21-032 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.