3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene

C8H2Br4S2 — CID 2740586

IUPAC3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene
SMILESBrc1cc(Br)c(-c2sc(Br)cc2Br)s1
InChIInChI=1S/C8H2Br4S2/c9-3-1-5(11)13-7(3)8-4(10)2-6(12)14-8/h1-2H
InChIKeyMOMHMPZSZNZLAK-UHFFFAOYSA-N
MW481.85 g/mol
LogP6.53
Rot. Bonds1

About 3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene

3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene (PubChem CID 2740586) has the molecular formula C8H2Br4S2 and a molecular weight of 481.85 g/mol. Its IUPAC name is 3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene.

Molecular Properties

Compound Name3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene
PubChem CID2740586
Molecular FormulaC8H2Br4S2
Molecular Weight481.85 g/mol
Exact Mass477.63
IUPAC Name3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene
SMILESBrc1cc(Br)c(-c2sc(Br)cc2Br)s1
InChIInChI=1S/C8H2Br4S2/c9-3-1-5(11)13-7(3)8-4(10)2-6(12)14-8/h1-2H
InChIKeyMOMHMPZSZNZLAK-UHFFFAOYSA-N
XLogP6.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500481.85
LogP ≤ 56.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5,5'-Dibromo-2,2'-bithiophene
CID 638908
5,5''-Dibromo-2,2':5',2''-terthiophene
CID 176690
2-Bromo-5-(5-thiophen-2-ylthiophen-2-yl)thiophene
CID 185352
5-Bromo-5'-(tridecafluorohexyl)-2,2'-bithiophene
CID 11203820
5-Bromo-[2,2']bithiophenyl
CID 640065
3,3'-Dibromo-2,2'-bithiophene
CID 819087
5-Bromo-5'-hexyl-2,2'-bithiophene
CID 59752457
2,5-Dibromothieno(3,2-b)thiophene
CID 3597455
2,6-Dibromodithieno(3,2-b:2',3'-d)thiophene
CID 11382649
3,3'-Dibromo-5,5'-bis(trimethylsilyl)-2,2'-bithiophene
CID 15860540
5,5'-Dibromo-3,3'-difluoro-2,2'-bithiophene
CID 118542755
4,4'-Dibromo-2,2'-bithiophene
CID 716032

Frequently Asked Questions

What is the IUPAC name of 3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene?
The IUPAC name of 3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene (CID 2740586) is 3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene.
What is the SMILES notation for 3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene?
The canonical SMILES for 3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene is Brc1cc(Br)c(-c2sc(Br)cc2Br)s1.
What is the InChIKey of 3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene?
The InChIKey is MOMHMPZSZNZLAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H2Br4S2/c9-3-1-5(11)13-7(3)8-4(10)2-6(12)14-8/h1-2H.
What are the key properties of 3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene?
3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene has a molecular weight of 481.85 g/mol, XLogP of 6.53, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibromo-2-(3,5-dibromothiophen-2-yl)thiophene is sourced from PubChem (CID 2740586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).