2,5-Dibromothieno(3,2-b)thiophene

C₆H₂Br₂S₂CAS 25121-87-3298.01 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₂Br₂S₂
Molar mass: 298.01 g/mol
Exact mass: 295.7965 Da
logP: 4.49Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Hazards

Danger

H301 Toxic if swallowed97.6% of notifiers

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P270, P301+P316, P321, P330, P405, P501

Identifiers

CAS number

25121-87-3

SMILES

C1=C(SC2=C1SC(=C2)Br)Br

InChIKey

APDAUBNBDJUQGW-UHFFFAOYSA-N

InChI

InChI=1S/C6H2Br2S2/c7-5-1-3-4(10-5)2-6(8)9-3/h1-2H

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Names and synonyms

1 names

2,5-Dibromothieno[3,2-B]thiophene

Work with 2,5-Dibromothieno(3,2-b)thiophene

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

2,6-Dibromodithieno[3,2-B:2',3'-D]thiophene67061-69-263 % similar 2-Bromobenzo(b)thiophene5394-13-852 % similar 3,3',5,5'-Tetrabromo-2,2'-bithiophene125143-53-548 % similar 2,3,5-Tribromothiophene3141-24-045 % similar 2,5-Dibromothiophene3141-27-344 % similar 2,5-Dibromo-3-methylthiophene13191-36-142 % similar 5,5'-Dibromo-2,2'-bithiophene4805-22-538 % similar 2,4-Dibromothiophene3140-92-935 % similar

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

Same formula

3,6-Dibromothieno(3,2-b)thiophene392662-65-6

Elsewhere

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