(3,5-Dibromophenyl)methanol

C₇H₆Br₂OCAS 145691-59-4265.93 g/mol

Open in Covalent MOL file

Alcohol Aryl 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 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

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 4-Bromobenzyl alcohol873-75-657 % similar 3,5-Dihydroxybenzyl alcohol29654-55-546 % similar 3,5-Dimethylbenzyl alcohol27129-87-944 % similar 3,5-Dichlorobenzyl alcohol60211-57-644 % similar 3,5-Dibromophenol626-41-543 % similar 1,4-Benzenedimethanol589-29-743 % 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 2,4-Dibromobenzenemethanol666747-06-4 1,3-Dibromo-5-methoxybenzene74137-36-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook