2,6-Dibromo-4-fluorophenol

C₆H₃Br₂FOCAS 344-20-7269.90 g/mol

Open in Covalent MOL file

Aryl halide Phenol

Properties

Molecular formula: C₆H₃Br₂FO
Molar mass: 269.90 g/mol
Exact mass: 267.8535 Da
Melting point: 56 °C
logP: 3.06Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H312 Harmful in contact with skin90.9% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled90.9% of notifiers
H335 May cause respiratory irritation97.7% of notifiers

Aggregated from 44 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

344-20-7

SMILES

Oc1c(Br)cc(F)cc1Br

InChIKey

RRAZCUUOWIDAJS-UHFFFAOYSA-N

InChI

InChI=1S/C6H3Br2FO/c7-4-1-3(9)2-5(8)6(4)10/h1-2,10H

Weigh it out

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

Names and synonyms

3 names

Phenol, 2,6-dibromo-4-fluoro-
4-Fluoro-2,6-dibromophenol
NSC 190640

Work with 2,6-Dibromo-4-fluorophenol

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

2-Bromo-4,6-difluorophenol98130-56-475 % similar 2-Bromo-4-fluorophenol496-69-558 % similar 2,4,6-Tribromophenol118-79-657 % similar 1,3-Dibromo-2,5-difluorobenzene128259-68-757 % similar 1,2,3-Tribromo-5-fluorobenzene576-82-957 % similar 1,3-Dibromo-2-chloro-5-fluorobenzene179897-90-652 % similar 2,6-Dibromo-4-methylphenol2432-14-652 % similar 2,6-Dibromo-4-fluoroaniline344-18-352 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2,4-Dibromo-6-fluorophenol576-86-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook