(3,5-Dibromophenyl)methanol

C7H6Br2OCAS 145691-59-4265.93 g/mol

Open in Covalent MOL file
BrBrOH
AlcoholAryl halide

Properties

Molecular formula
C7H6Br2O
Molar mass
265.93 g/mol
Exact mass
263.8785 Da
logP
2.70Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 7 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
145691-59-4
SMILES
C1=C(C=C(C=C1Br)Br)CO
InChIKey
ZQNSHKZQTZSNTB-UHFFFAOYSA-N
InChI
InChI=1S/C7H6Br2O/c8-6-1-5(4-10)2-7(9)3-6/h1-3,10H,4H2

Weigh it out

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

Names and synonyms

1 names
  • 3,5-Dibromobenzyl alcohol

Work with (3,5-Dibromophenyl)methanol

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

(3-Bromo-5-fluorophenyl)methanol216755-56-568 % similar 3-Bromobenzenemethanol15852-73-060 % similar 1,3,5-Benzenetrimethanol4464-18-058 % similar (5-Bromo-3-pyridinyl)methanol37669-64-058 % similar 4-Bromobenzyl alcohol873-75-657 % similar 3,5-Dibromobenzyl bromide56908-88-452 % similar 1,3,5-Tribromobenzene626-39-150 % similar 4-Bromo-2,6-difluorobenzyl alcohol162744-59-448 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3,5-Dibromo-4-methylphenol13979-81-2 2,4-Dibromoanisole21702-84-1 2,6-Dibromo-4-methylphenol2432-14-6 2,6-Dibromoanisole38603-09-7 2,4-Dibromobenzenemethanol666747-06-4 1,3-Dibromo-5-methoxybenzene74137-36-3

Elsewhere

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