(3R)-3-[4-(trifluoromethyl)phenyl]oxolane

C11H11F3O — CID 166447213

IUPAC(3R)-3-[4-(trifluoromethyl)phenyl]oxolane
SMILESFC(F)(F)c1ccc([C@H]2CCOC2)cc1
InChIInChI=1S/C11H11F3O/c12-11(13,14)10-3-1-8(2-4-10)9-5-6-15-7-9/h1-4,9H,5-7H2/t9-/m0/s1
InChIKeyOHQDQYWXIPHDLJ-VIFPVBQESA-N
MW216.20 g/mol
LogP3.21
Rot. Bonds1

About (3R)-3-[4-(trifluoromethyl)phenyl]oxolane

(3R)-3-[4-(trifluoromethyl)phenyl]oxolane (PubChem CID 166447213) has the molecular formula C11H11F3O and a molecular weight of 216.20 g/mol. Its IUPAC name is (3R)-3-[4-(trifluoromethyl)phenyl]oxolane.

Molecular Properties

Compound Name(3R)-3-[4-(trifluoromethyl)phenyl]oxolane
PubChem CID166447213
Molecular FormulaC11H11F3O
Molecular Weight216.20 g/mol
Exact Mass216.08
IUPAC Name(3R)-3-[4-(trifluoromethyl)phenyl]oxolane
SMILESFC(F)(F)c1ccc([C@H]2CCOC2)cc1
InChIInChI=1S/C11H11F3O/c12-11(13,14)10-3-1-8(2-4-10)9-5-6-15-7-9/h1-4,9H,5-7H2/t9-/m0/s1
InChIKeyOHQDQYWXIPHDLJ-VIFPVBQESA-N
XLogP3.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.20
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-[4-(trifluoromethyl)phenyl]oxolane?
The IUPAC name of (3R)-3-[4-(trifluoromethyl)phenyl]oxolane (CID 166447213) is (3R)-3-[4-(trifluoromethyl)phenyl]oxolane.
What is the SMILES notation for (3R)-3-[4-(trifluoromethyl)phenyl]oxolane?
The canonical SMILES for (3R)-3-[4-(trifluoromethyl)phenyl]oxolane is FC(F)(F)c1ccc([C@H]2CCOC2)cc1.
What is the InChIKey of (3R)-3-[4-(trifluoromethyl)phenyl]oxolane?
The InChIKey is OHQDQYWXIPHDLJ-VIFPVBQESA-N. The full InChI is InChI=1S/C11H11F3O/c12-11(13,14)10-3-1-8(2-4-10)9-5-6-15-7-9/h1-4,9H,5-7H2/t9-/m0/s1.
What are the key properties of (3R)-3-[4-(trifluoromethyl)phenyl]oxolane?
(3R)-3-[4-(trifluoromethyl)phenyl]oxolane has a molecular weight of 216.20 g/mol, XLogP of 3.21, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[4-(trifluoromethyl)phenyl]oxolane is sourced from PubChem (CID 166447213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).