6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol

C11H10BrFO — CID 153220792

IUPAC6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol
SMILESOc1c(Br)ccc(C2=CCCC2)c1F
InChIInChI=1S/C11H10BrFO/c12-9-6-5-8(10(13)11(9)14)7-3-1-2-4-7/h3,5-6,14H,1-2,4H2
InChIKeyWNPOZFDSCONAPA-UHFFFAOYSA-N
MW257.10 g/mol
LogP3.86
Rot. Bonds1

About 6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol

6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol (PubChem CID 153220792) has the molecular formula C11H10BrFO and a molecular weight of 257.10 g/mol. Its IUPAC name is 6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol.

Molecular Properties

Compound Name6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol
PubChem CID153220792
Molecular FormulaC11H10BrFO
Molecular Weight257.10 g/mol
Exact Mass255.99
IUPAC Name6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol
SMILESOc1c(Br)ccc(C2=CCCC2)c1F
InChIInChI=1S/C11H10BrFO/c12-9-6-5-8(10(13)11(9)14)7-3-1-2-4-7/h3,5-6,14H,1-2,4H2
InChIKeyWNPOZFDSCONAPA-UHFFFAOYSA-N
XLogP3.86
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.10
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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4-chloro-2-(cyclohexen-1-yl)-1-fluorobenzene
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Frequently Asked Questions

What is the IUPAC name of 6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol?
The IUPAC name of 6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol (CID 153220792) is 6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol.
What is the SMILES notation for 6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol?
The canonical SMILES for 6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol is Oc1c(Br)ccc(C2=CCCC2)c1F.
What is the InChIKey of 6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol?
The InChIKey is WNPOZFDSCONAPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10BrFO/c12-9-6-5-8(10(13)11(9)14)7-3-1-2-4-7/h3,5-6,14H,1-2,4H2.
What are the key properties of 6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol?
6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol has a molecular weight of 257.10 g/mol, XLogP of 3.86, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-3-(cyclopenten-1-yl)-2-fluorophenol is sourced from PubChem (CID 153220792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).