2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran

C15H11F3O2 — CID 141104992

IUPAC2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran
SMILESFC(F)(F)Oc1ccccc1C1Cc2ccccc2O1
InChIInChI=1S/C15H11F3O2/c16-15(17,18)20-13-8-4-2-6-11(13)14-9-10-5-1-3-7-12(10)19-14/h1-8,14H,9H2
InChIKeyOEWHFBKWMLRHFY-UHFFFAOYSA-N
MW280.25 g/mol
LogP4.26
Rot. Bonds2

About 2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran

2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran (PubChem CID 141104992) has the molecular formula C15H11F3O2 and a molecular weight of 280.25 g/mol. Its IUPAC name is 2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran.

Molecular Properties

Compound Name2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran
PubChem CID141104992
Molecular FormulaC15H11F3O2
Molecular Weight280.25 g/mol
Exact Mass280.07
IUPAC Name2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran
SMILESFC(F)(F)Oc1ccccc1C1Cc2ccccc2O1
InChIInChI=1S/C15H11F3O2/c16-15(17,18)20-13-8-4-2-6-11(13)14-9-10-5-1-3-7-12(10)19-14/h1-8,14H,9H2
InChIKeyOEWHFBKWMLRHFY-UHFFFAOYSA-N
XLogP4.26
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.25
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran?
The IUPAC name of 2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran (CID 141104992) is 2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran.
What is the SMILES notation for 2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran?
The canonical SMILES for 2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran is FC(F)(F)Oc1ccccc1C1Cc2ccccc2O1.
What is the InChIKey of 2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran?
The InChIKey is OEWHFBKWMLRHFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11F3O2/c16-15(17,18)20-13-8-4-2-6-11(13)14-9-10-5-1-3-7-12(10)19-14/h1-8,14H,9H2.
What are the key properties of 2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran?
2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran has a molecular weight of 280.25 g/mol, XLogP of 4.26, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(trifluoromethoxy)phenyl]-2,3-dihydro-1-benzofuran is sourced from PubChem (CID 141104992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).