chempirical

2-Bromo-5-iodobenzyl alcohol

C7H6BrIOCAS 946525-30-0312.93 g/mol

Open in Covalent MOL file
IOHBr
AlcoholAryl halide

Properties

Molecular formula
C7H6BrIO
Molar mass
312.93 g/mol
Exact mass
311.8647 Da
logP
2.55Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
946525-30-0
SMILES
C1=CC(=C(C=C1I)CO)Br
InChIKey
WDXHGFYJUQMFDV-UHFFFAOYSA-N
InChI
InChI=1S/C7H6BrIO/c8-7-2-1-6(9)3-5(7)4-10/h1-3,10H,4H2

Weigh it out

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Names and synonyms

1 names
  • (2-Bromo-5-iodophenyl)methanol

Work with 2-Bromo-5-iodobenzyl alcohol

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-5-fluorobenzenemethanol202865-66-556 % similar 2-Bromobenzyl alcohol18982-54-252 % similar 2-Bromo-5-iodophenol932372-99-152 % similar 2-Bromo-5-(trifluoromethyl)benzyl alcohol869725-53-151 % similar 2-Bromo-5-iodotoluene202865-85-848 % similar 1-Bromo-2-fluoro-4-iodobenzene136434-77-047 % similar 1-Bromo-2-chloro-4-iodobenzene535934-25-947 % similar 2,4-Dibromobenzenemethanol666747-06-445 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Bromo-1-iodo-4-methoxybenzene466639-53-2 4-Bromo-1-iodo-2-methoxybenzene791642-68-7

Elsewhere

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