3,3'-Dibromo-2,2'-bithiophene

C₈H₄Br₂S₂CAS 51751-44-1324.05 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₈H₄Br₂S₂
Molar mass: 324.05 g/mol
Exact mass: 321.8121 Da
logP: 5.00Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 2
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

51751-44-1

SMILES

C1=CSC(=C1Br)C2=C(C=CS2)Br

InChIKey

KBRZCEVRNLKHAZ-UHFFFAOYSA-N

InChI

InChI=1S/C8H4Br2S2/c9-5-1-3-11-7(5)8-6(10)2-4-12-8/h1-4H

Weigh it out

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Work with 3,3'-Dibromo-2,2'-bithiophene

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-2-chlorothiophene40032-73-359 % similar 2,3-Dibromothiophene3140-93-057 % similar 7-Bromo-benzo[B]thiophene1423-61-650 % similar 4-Bromobenzo[b]thiophene5118-13-848 % similar 3-Bromo-2-thiophenecarbonitrile18791-98-546 % similar 3-Bromothieno(3,2-b)thiophene25121-83-942 % similar 3-Bromothiophene-2-carboxylic acid7311-64-041 % similar 3,4-Dithia-7H-cyclopenta[A]pentalene389-58-239 % similar

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

Same formula

5,5'-Dibromo-2,2'-bithiophene4805-22-5

Elsewhere

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