chempirical

Tetrabromothiophene

C4Br4SCAS 3958-03-0399.72 g/mol

Open in Covalent MOL file
BrSBrBrBr
Aryl halide

Properties

Molecular formula
C4Br4S
Molar mass
399.72 g/mol
Exact mass
395.6454 Da
Melting point
117.5 °C
Boiling point
326 °C
logP
4.80Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Identifiers

CAS number
3958-03-0
SMILES
Brc1sc(Br)c(Br)c1Br
InChIKey
AVPWUAFYDNQGNZ-UHFFFAOYSA-N
InChI
InChI=1S/C4Br4S/c5-1-2(6)4(8)9-3(1)7

Weigh it out

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

Names and synonyms

4 names
  • Thiophene, 2,3,4,5-tetrabromo-
  • Thiophene, tetrabromo-
  • 2,3,4,5-Tetrabromothiophene
  • NSC 65427

Work with Tetrabromothiophene

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

2,3,5-Tribromo-4-methylthiophene67869-13-058 % similar 2,3,4-Tribromothiophene3141-25-143 % similar 2,3,5-Tribromothiophene3141-24-030 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook