3-Bromoanisole
Properties
- Molecular formula
- C7H7BrO
- Molar mass
- 187.04 g/mol
- Exact mass
- 185.9680 Da
- Melting point
- 106.7 °C
- Boiling point
- 211 °C
- logP
- 2.46Crippen estimate
- Polar surface area
- 9.2 Ų
- H-bond donors / acceptors
- 0 / 1
- Rotatable bonds
- 1
Identifiers
CAS number
2398-37-0SMILES
COc1cccc(Br)c1InChIKey
PLDWAJLZAAHOGG-UHFFFAOYSA-NInChI
InChI=1S/C7H7BrO/c1-9-7-4-2-3-6(8)5-7/h2-5H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
14 names · show all
- Benzene, 1-bromo-3-methoxy-
- Anisole, m-bromo-
- 1-Bromo-3-methoxybenzene
- m-Bromophenyl methyl ether
- 3-Methoxy-1-bromobenzene
- m-Bromoanisole
- 3-Methoxybromobenzene
- m-Bromomethoxybenzene
- m-Methoxybromobenzene
- m-Anisyl bromide
- 3-Methoxyphenyl bromide
- m-Methoxyphenyl bromide
- NSC 82293
- 3-Bromobenzene methyl ether
Work with 3-Bromoanisole
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
1,3-Dimethoxybenzene151-10-065 % similar
1,3-Dibromo-5-methoxybenzene74137-36-360 % similar
2-Bromo-6-methoxynaphthalene5111-65-959 % similar
1-Bromo-3-isopropoxybenzene131738-73-357 % similar
1-Bromo-3-ethoxybenzene2655-84-757 % similar
3-Methylanisole100-84-554 % similar
3-Methoxybenzenethiol15570-12-454 % similar
3-Chloroanisole2845-89-854 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds