1-Bromo-2,4-dimethylbenzene
Properties
- Molecular formula
- C8H9Br
- Molar mass
- 185.06 g/mol
- Exact mass
- 183.9888 Da
- Density
- 1.361 g/mL (at 20 °C)
- Melting point
- −17 °C
- Boiling point
- 205 °C
- logP
- 3.07Crippen estimate
- Polar surface area
- 0.0 Ų
- H-bond donors / acceptors
- 0 / 0
- Rotatable bonds
- 0
Identifiers
CAS number
583-70-0SMILES
Cc1ccc(Br)c(C)c1InChIKey
YSFLQVNTBBUKEA-UHFFFAOYSA-NInChI
InChI=1S/C8H9Br/c1-6-3-4-8(9)7(2)5-6/h3-5H,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
12 names
- Benzene, 1-bromo-2,4-dimethyl-
- m-Xylene, 4-bromo-
- 1,3-Dimethyl-4-bromobenzene
- 2,4-Dimethylbromobenzene
- 4-Bromo-m-xylene
- 1-Bromo-2,4-xylene
- 2,4-Dimethylphenyl bromide
- 4-Bromo-1,3-dimethylbenzene
- 4-Bromo-1,3-xylene
- 2-Bromo-5-methyltoluene
- NSC 64734
- 2,4-Dimethyl-1-bromobenzene
Work with 1-Bromo-2,4-dimethylbenzene
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-Dibromo-4-methylbenzene60956-23-265 % similar
2,5-Dibromotoluene615-59-860 % similar
1,2,4-Trimethylbenzene95-63-657 % similar
4-Bromo-3-methylphenol14472-14-156 % similar
1-Bromo-4-chloro-2-methylbenzene14495-51-356 % similar
2-Bromo-5-fluorotoluene452-63-156 % similar
4-Bromo-3-fluorotoluene452-74-456 % similar
4-Bromo-3-methylaniline6933-10-456 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds