3-(5-bromo-2-fluorophenoxy)oxolane

C10H10BrFO2 — CID 114672573

IUPAC3-(5-bromo-2-fluorophenoxy)oxolane
SMILESFc1ccc(Br)cc1OC1CCOC1
InChIInChI=1S/C10H10BrFO2/c11-7-1-2-9(12)10(5-7)14-8-3-4-13-6-8/h1-2,5,8H,3-4,6H2
InChIKeyLEFMAXXGSZGGME-UHFFFAOYSA-N
MW261.09 g/mol
LogP2.76
Rot. Bonds2

About 3-(5-bromo-2-fluorophenoxy)oxolane

3-(5-bromo-2-fluorophenoxy)oxolane (PubChem CID 114672573) has the molecular formula C10H10BrFO2 and a molecular weight of 261.09 g/mol. Its IUPAC name is 3-(5-bromo-2-fluorophenoxy)oxolane.

Molecular Properties

Compound Name3-(5-bromo-2-fluorophenoxy)oxolane
PubChem CID114672573
Molecular FormulaC10H10BrFO2
Molecular Weight261.09 g/mol
Exact Mass259.98
IUPAC Name3-(5-bromo-2-fluorophenoxy)oxolane
SMILESFc1ccc(Br)cc1OC1CCOC1
InChIInChI=1S/C10H10BrFO2/c11-7-1-2-9(12)10(5-7)14-8-3-4-13-6-8/h1-2,5,8H,3-4,6H2
InChIKeyLEFMAXXGSZGGME-UHFFFAOYSA-N
XLogP2.76
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.09
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(5-bromo-2-fluorophenoxy)-1,9-dioxaspiro[5.5]undecane
CID 114672924
4-bromo-2-cyclohexyloxy-1-fluorobenzene
CID 114672606
(3S)-3-(4-bromo-2,6-difluorophenoxy)oxolane
CID 121407954
(3S)-3-(2-bromo-5-fluorophenoxy)oxolane
CID 118590561
5-bromo-2-(oxolan-3-yloxy)benzenesulfonamide
CID 63559381
(1R)-1-[5-bromo-2-(oxolan-3-yloxy)phenyl]ethanamine
CID 63556778
(3R)-3-(4-fluoro-3-methylphenoxy)oxolane
CID 170235553
1-[4-bromo-2-(oxan-3-yloxy)phenyl]ethanol
CID 107135111
(1R)-1-[3-fluoro-4-(oxolan-3-yloxy)phenyl]ethanamine
CID 63558652
[5-bromo-2-(oxan-3-yloxy)phenyl]methanol
CID 107135040
5-bromo-2-(oxan-3-yloxy)benzaldehyde
CID 107134803
2-bromo-3-fluoro-4-(oxolan-3-yloxy)benzonitrile
CID 107534381

Frequently Asked Questions

What is the IUPAC name of 3-(5-bromo-2-fluorophenoxy)oxolane?
The IUPAC name of 3-(5-bromo-2-fluorophenoxy)oxolane (CID 114672573) is 3-(5-bromo-2-fluorophenoxy)oxolane.
What is the SMILES notation for 3-(5-bromo-2-fluorophenoxy)oxolane?
The canonical SMILES for 3-(5-bromo-2-fluorophenoxy)oxolane is Fc1ccc(Br)cc1OC1CCOC1.
What is the InChIKey of 3-(5-bromo-2-fluorophenoxy)oxolane?
The InChIKey is LEFMAXXGSZGGME-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrFO2/c11-7-1-2-9(12)10(5-7)14-8-3-4-13-6-8/h1-2,5,8H,3-4,6H2.
What are the key properties of 3-(5-bromo-2-fluorophenoxy)oxolane?
3-(5-bromo-2-fluorophenoxy)oxolane has a molecular weight of 261.09 g/mol, XLogP of 2.76, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-bromo-2-fluorophenoxy)oxolane is sourced from PubChem (CID 114672573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).