1,2,4-Tribromobenzene

C₆H₃Br₃CAS 615-54-3314.80 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₃Br₃
Molar mass: 314.80 g/mol
Exact mass: 311.7785 Da
Melting point: 44.5 °C
Boiling point: 275 °C
logP: 3.97Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Identifiers

CAS number

615-54-3

SMILES

Brc1ccc(Br)c(Br)c1

InChIKey

FWAJPSIPOULHHH-UHFFFAOYSA-N

InChI

InChI=1S/C6H3Br3/c7-4-1-2-5(8)6(9)3-4/h1-3H

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

Names and synonyms

2 names

Benzene, 1,2,4-tribromo-
NSC 62440

Work with 1,2,4-Tribromobenzene

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,4-Dibromo-1-fluorobenzene1435-53-657 % similar 2,4-Dibromo-1-methylbenzene31543-75-657 % similar 2,5-Dibromoaniline3638-73-157 % similar 2,4-Dibromoaniline615-57-657 % similar 2,4-Dibromophenol615-58-757 % similar 2,5-Dibromotoluene615-59-857 % similar 2,4-Dibromoanisole21702-84-150 % similar 2,4-Dibromobenzenemethanol666747-06-450 % similar

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

Same formula

1,3,5-Tribromobenzene626-39-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook