1,2,3-Tribromopropane
Properties
- Molecular formula
- C3H5Br3
- Molar mass
- 280.78 g/mol
- Exact mass
- 277.7941 Da
- Density
- 1.4215 g/mL (at 20 °C)
- Melting point
- 16.9 °C
- Boiling point
- 222.1 °C
- logP
- 2.54Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 2
Hazards
Warning
- H302 Harmful if swallowed97.7% of notifiers
- H312 Harmful in contact with skin88.6% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H332 Harmful if inhaled88.6% of notifiers
- H335 May cause respiratory irritation88.6% of notifiers
- H351 Suspected of causing cancer86.4% of notifiers
Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
96-11-7SMILES
BrCC(Br)CBrInChIKey
FHCLGDLYRUPKAM-UHFFFAOYSA-NInChI
InChI=1S/C3H5Br3/c4-1-3(6)2-5/h3H,1-2H2Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
4 names
- Propane, 1,2,3-tribromo-
- Glycerol tribromohydrin
- Sym-Tribromopropane
- NSC 78932
Reactions
Work with 1,2,3-Tribromopropane
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
1,2-Dibromobutane533-98-259 % similar
1,2-Dibromo-3-chloropropane96-12-859 % similar
2,3-Dibromo-1-propanol96-13-959 % similar
1,2,3,4-Tetrabromobutane1529-68-647 % similar
1,1,2-Tribromoethane78-74-047 % similar
Tris(2,3-dibromopropyl) phosphate126-72-743 % similar
Tris(2,3-dibromopropyl) isocyanurate52434-90-943 % similar
Hexabromocyclododecane25637-99-443 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds