2-bromo-5-fluorothiophene

C4H2BrFS — CID 14786521

IUPAC2-bromo-5-fluorothiophene
SMILESFc1ccc(Br)s1
InChIInChI=1S/C4H2BrFS/c5-3-1-2-4(6)7-3/h1-2H
InChIKeyWMCDDNAETBQBMJ-UHFFFAOYSA-N
MW181.03 g/mol
LogP2.65
Rot. Bonds

About 2-bromo-5-fluorothiophene

2-bromo-5-fluorothiophene (PubChem CID 14786521) has the molecular formula C4H2BrFS and a molecular weight of 181.03 g/mol. Its IUPAC name is 2-bromo-5-fluorothiophene.

Molecular Properties

Compound Name2-bromo-5-fluorothiophene
PubChem CID14786521
Molecular FormulaC4H2BrFS
Molecular Weight181.03 g/mol
Exact Mass179.90
IUPAC Name2-bromo-5-fluorothiophene
SMILESFc1ccc(Br)s1
InChIInChI=1S/C4H2BrFS/c5-3-1-2-4(6)7-3/h1-2H
InChIKeyWMCDDNAETBQBMJ-UHFFFAOYSA-N
XLogP2.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.03
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-fluorothiophene?
The IUPAC name of 2-bromo-5-fluorothiophene (CID 14786521) is 2-bromo-5-fluorothiophene.
What is the SMILES notation for 2-bromo-5-fluorothiophene?
The canonical SMILES for 2-bromo-5-fluorothiophene is Fc1ccc(Br)s1.
What is the InChIKey of 2-bromo-5-fluorothiophene?
The InChIKey is WMCDDNAETBQBMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H2BrFS/c5-3-1-2-4(6)7-3/h1-2H.
What are the key properties of 2-bromo-5-fluorothiophene?
2-bromo-5-fluorothiophene has a molecular weight of 181.03 g/mol, XLogP of 2.65, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-fluorothiophene is sourced from PubChem (CID 14786521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).