2,4-Dibromo-1,3,5-trimethylbenzene
Properties
- Molecular formula
- C9H10Br2
- Molar mass
- 277.99 g/mol
- Exact mass
- 275.9149 Da
- Melting point
- 65.5 °C
- Boiling point
- 285 °C
- logP
- 4.14Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 0
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation97.9% of notifiers
Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
6942-99-0SMILES
Cc1cc(C)c(Br)c(C)c1BrInChIKey
CIHJFEWFZJQTFE-UHFFFAOYSA-NInChI
InChI=1S/C9H10Br2/c1-5-4-6(2)9(11)7(3)8(5)10/h4H,1-3H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- Benzene, 2,4-dibromo-1,3,5-trimethyl-
- Mesitylene, 2,4-dibromo-
- 2,4-Dibromomesitylene
- NSC 51629
- 1,3-Dibromo-2,4,6-trimethylbenzene
Work with 2,4-Dibromo-1,3,5-trimethylbenzene
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
3-Bromo-1,2,4,5-tetramethylbenzene1646-53-370 % similar
3-Bromo-2,4,6-trimethylaniline82842-52-267 % similar
2,3,5,6-Tetrabromo-p-xylene23488-38-256 % similar
1,3,5-Tribromo-2,4,6-trimethylbenzene608-72-056 % similar
1,5-Dibromo-2,4-bis-bromomethyl-benzene35510-03-355 % similar
Mesityl bromide576-83-055 % similar
2-Bromo-4-nitro-1,3,5-trimethylbenzene90561-85-653 % similar
Pentabromotoluene87-83-253 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.