1,3-Dibromo-5-methoxybenzene

C7H6Br2OCAS 74137-36-3265.93 g/mol

Open in Covalent MOL file
OBrBr
Aryl halideEther

Properties

Molecular formula
C7H6Br2O
Molar mass
265.93 g/mol
Exact mass
263.8785 Da
Melting point
38 °C
logP
3.22Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
1

Hazards

Danger
Acute Toxic (GHS06)

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P316, P321, P330, P405, P501

Identifiers

CAS number
74137-36-3
SMILES
COc1cc(Br)cc(Br)c1
InChIKey
OQZAQBGJENJMHT-UHFFFAOYSA-N
InChI
InChI=1S/C7H6Br2O/c1-10-7-3-5(8)2-6(9)4-7/h2-4H,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names
  • Benzene, 1,3-dibromo-5-methoxy-
  • 3,5-Dibromoanisole
  • 3,5-Bromo-1-methoxyphenyl

Work with 1,3-Dibromo-5-methoxybenzene

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1-Bromo-3,5-dimethoxybenzene20469-65-289 % similar 1-Bromo-3-methoxy-5-methylbenzene29578-83-471 % similar 3-Bromo-5-fluoroanisole29578-39-068 % similar 3-Bromo-5-methoxybenzaldehyde262450-65-761 % similar 3-Bromoanisole2398-37-060 % similar 1,3,5-Trimethoxybenzene621-23-858 % similar 3-Bromo-5-methoxypyridine50720-12-258 % similar 3-Bromo-5-methoxybenzoic acid157893-14-657 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3,5-Dibromo-4-methylphenol13979-81-2 (3,5-Dibromophenyl)methanol145691-59-4 2,4-Dibromoanisole21702-84-1 2,6-Dibromo-4-methylphenol2432-14-6 2,6-Dibromoanisole38603-09-7 2,4-Dibromobenzenemethanol666747-06-4

Elsewhere

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