chempirical

2,6-Dibromo-4,4-bis(2-ethylhexyl)-4H-silolo[3,2-B:4,5-B']dithiophene

C24H36Br2S2SiCAS 1089687-05-7576.56 g/mol

Open in Covalent MOL file
SiSBrSBr
Aryl halide

Properties

Molecular formula
C24H36Br2S2Si
Molar mass
576.56 g/mol
Exact mass
574.0394 Da
logP
9.31Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
12

Identifiers

CAS number
1089687-05-7
SMILES
CCCCC(CC)C[Si]1(C2=C(C3=C1C=C(S3)Br)SC(=C2)Br)CC(CC)CCCC
InChIKey
CMMVJTQAECTXDZ-UHFFFAOYSA-N
InChI
InChI=1S/C24H36Br2S2Si/c1-5-9-11-17(7-3)15-29(16-18(8-4)12-10-6-2)19-13-21(25)27-23(19)24-20(29)14-22(26)28-24/h13-14,17-18H,5-12,15-16H2,1-4H3

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Work with 2,6-Dibromo-4,4-bis(2-ethylhexyl)-4H-silolo[3,2-B:4,5-B']dithiophene

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-Dibromo-4,4-bis(2-ethylhexyl)-4H-cyclopenta[2,1-B:3,4-B′]dithiophene365547-21-357 % similar 2,6-Dibromo-4,8-bis[(2-ethylhexyl)oxy]-benzo[1,2-B:4,5-B']dithiophene1226782-13-353 % similar Dichlorobis(2-ethylhexyl)silane1089687-03-542 % similar 3,6-Bis(5-bromo-2-thienyl)-2,5-bis(2-ethylhexyl)-2,5-dihydropyrrolo[3,4-C]pyrrole-1,4-dione1000623-95-938 % similar 2-Ethylhexyl bromide18908-66-238 % similar 3-(2-Ethylhexyl)thiophene121134-38-137 % similar Silicic acid (H4sio4) tetrakis(2-ethylhexyl) ester115-82-236 % similar 1,3-Bibromo-5-(2-ethylhexyl)-4H-thieno[3,4-C]pyrrole-4,6(5H)-dione1231160-83-036 % similar

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

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