2-bromo-3-fluorothiophene

C4H2BrFS — CID 14786519

IUPAC2-bromo-3-fluorothiophene
SMILESFc1ccsc1Br
InChIInChI=1S/C4H2BrFS/c5-4-3(6)1-2-7-4/h1-2H
InChIKeyCEGNDKAALPVWLG-UHFFFAOYSA-N
MW181.03 g/mol
LogP2.65
Rot. Bonds

About 2-bromo-3-fluorothiophene

2-bromo-3-fluorothiophene (PubChem CID 14786519) has the molecular formula C4H2BrFS and a molecular weight of 181.03 g/mol. Its IUPAC name is 2-bromo-3-fluorothiophene.

Molecular Properties

Compound Name2-bromo-3-fluorothiophene
PubChem CID14786519
Molecular FormulaC4H2BrFS
Molecular Weight181.03 g/mol
Exact Mass179.90
IUPAC Name2-bromo-3-fluorothiophene
SMILESFc1ccsc1Br
InChIInChI=1S/C4H2BrFS/c5-4-3(6)1-2-7-4/h1-2H
InChIKeyCEGNDKAALPVWLG-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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Related Compounds

2-Bromothiophene
CID 13851
3-Bromothiophene
CID 13383
2,5-Dibromothiophene
CID 18453
2,3-Dibromothiophene
CID 76590
Thiophene, 2,3,5-tribromo-
CID 76592
2-Bromo-5-iodothiophene
CID 639657
Thiophene, 2,4-dibromo-
CID 2724560
2-Bromo-3-iodothiophene
CID 10935115
2-Bromo-5-fluorothiophene
CID 14786521
4-Bromo-2-fluorothiophene
CID 12475299
2-Bromo-4-fluorothiophene
CID 14786520
2-Bromo-3-(trifluoromethyl)thiophene
CID 26596481

Frequently Asked Questions

What is the IUPAC name of 2-bromo-3-fluorothiophene?
The IUPAC name of 2-bromo-3-fluorothiophene (CID 14786519) is 2-bromo-3-fluorothiophene.
What is the SMILES notation for 2-bromo-3-fluorothiophene?
The canonical SMILES for 2-bromo-3-fluorothiophene is Fc1ccsc1Br.
What is the InChIKey of 2-bromo-3-fluorothiophene?
The InChIKey is CEGNDKAALPVWLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H2BrFS/c5-4-3(6)1-2-7-4/h1-2H.
What are the key properties of 2-bromo-3-fluorothiophene?
2-bromo-3-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-3-fluorothiophene is sourced from PubChem (CID 14786519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).