2,5-dibromothieno[3,2-b]thiophene

C6H2Br2S2 — CID 3597455

IUPAC2,5-dibromothieno[3,2-b]thiophene
SMILESBrc1cc2sc(Br)cc2s1
InChIInChI=1S/C6H2Br2S2/c7-5-1-3-4(10-5)2-6(8)9-3/h1-2H
InChIKeyAPDAUBNBDJUQGW-UHFFFAOYSA-N
MW298.02 g/mol
LogP4.49
Rot. Bonds

About 2,5-dibromothieno[3,2-b]thiophene

2,5-dibromothieno[3,2-b]thiophene (PubChem CID 3597455) has the molecular formula C6H2Br2S2 and a molecular weight of 298.02 g/mol. Its IUPAC name is 2,5-dibromothieno[3,2-b]thiophene.

Molecular Properties

Compound Name2,5-dibromothieno[3,2-b]thiophene
PubChem CID3597455
Molecular FormulaC6H2Br2S2
Molecular Weight298.02 g/mol
Exact Mass295.80
IUPAC Name2,5-dibromothieno[3,2-b]thiophene
SMILESBrc1cc2sc(Br)cc2s1
InChIInChI=1S/C6H2Br2S2/c7-5-1-3-4(10-5)2-6(8)9-3/h1-2H
InChIKeyAPDAUBNBDJUQGW-UHFFFAOYSA-N
XLogP4.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.02
LogP ≤ 54.49
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
3,3',5,5'-Tetrabromo-2,2'-bithiophene
CID 2740586
Thieno(2,3-b)thiophene, 2,5-dibromo-
CID 141180
2,3,5,6-Tetrabromothieno[3,2-b]thiophene
CID 2762568
3,6-Dibromothieno(3,2-b)thiophene
CID 10613979
2,6-Dibromodithieno(3,2-b:2',3'-d)thiophene
CID 11382649
5,5'-Dibromo-3,3'-difluoro-2,2'-bithiophene
CID 118542755
Thieno(2,3-b)thiophene,2,3,5-tribromo-
CID 143032
Bis(5-bromo-2-thienyl)methane
CID 10925774
3-Bromothieno(3,2-b)thiophene
CID 14383679
2,3,5-Tribromothieno(3,2-b)thiophene
CID 1211733

Frequently Asked Questions

What is the IUPAC name of 2,5-dibromothieno[3,2-b]thiophene?
The IUPAC name of 2,5-dibromothieno[3,2-b]thiophene (CID 3597455) is 2,5-dibromothieno[3,2-b]thiophene.
What is the SMILES notation for 2,5-dibromothieno[3,2-b]thiophene?
The canonical SMILES for 2,5-dibromothieno[3,2-b]thiophene is Brc1cc2sc(Br)cc2s1.
What is the InChIKey of 2,5-dibromothieno[3,2-b]thiophene?
The InChIKey is APDAUBNBDJUQGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2Br2S2/c7-5-1-3-4(10-5)2-6(8)9-3/h1-2H.
What are the key properties of 2,5-dibromothieno[3,2-b]thiophene?
2,5-dibromothieno[3,2-b]thiophene has a molecular weight of 298.02 g/mol, XLogP of 4.49, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dibromothieno[3,2-b]thiophene is sourced from PubChem (CID 3597455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).