(2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane

C16H15F3O — CID 166443762

IUPAC(2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane
SMILESFC(F)(F)C[C@@]1(c2ccc3ccccc3c2)CCCO1
InChIInChI=1S/C16H15F3O/c17-16(18,19)11-15(8-3-9-20-15)14-7-6-12-4-1-2-5-13(12)10-14/h1-2,4-7,10H,3,8-9,11H2/t15-/m1/s1
InChIKeyBQQDUNKUMFNFLX-OAHLLOKOSA-N
MW280.29 g/mol
LogP4.80
Rot. Bonds2

About (2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane

(2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane (PubChem CID 166443762) has the molecular formula C16H15F3O and a molecular weight of 280.29 g/mol. Its IUPAC name is (2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane.

Molecular Properties

Compound Name(2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane
PubChem CID166443762
Molecular FormulaC16H15F3O
Molecular Weight280.29 g/mol
Exact Mass280.11
IUPAC Name(2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane
SMILESFC(F)(F)C[C@@]1(c2ccc3ccccc3c2)CCCO1
InChIInChI=1S/C16H15F3O/c17-16(18,19)11-15(8-3-9-20-15)14-7-6-12-4-1-2-5-13(12)10-14/h1-2,4-7,10H,3,8-9,11H2/t15-/m1/s1
InChIKeyBQQDUNKUMFNFLX-OAHLLOKOSA-N
XLogP4.80
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.29
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(Naphthalen-2-yl)oxirane
CID 30333
1-Naphthylmethyl methyl ether
CID 22195
2-(3,5-Bis-trifluoromethyl-benzyloxymethyl)-biphenyl
CID 18546500
Naphthalan
CID 588214
2,2,2-Trifluoro-1-(naphthalen-2-yl)ethan-1-ol
CID 3765592
3-Naphthalen-2-yl-8-oxabicyclo[3.2.1]oct-2-ene
CID 70687403
9-Anthryloxirane
CID 43720
1a,9a-Dihydrophenanthro(1,2-b)oxirene
CID 148323
1a,9c-Dihydrophenanthro(3,4-b)oxirene
CID 148324
Pyrene-1,2-oxide
CID 9543286
Benzanthracene-8,9-oxide
CID 36838
9,10-Epoxy-9,10-dihydrobenz(j)aceanthrylene
CID 148349

Frequently Asked Questions

What is the IUPAC name of (2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane?
The IUPAC name of (2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane (CID 166443762) is (2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane.
What is the SMILES notation for (2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane?
The canonical SMILES for (2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane is FC(F)(F)C[C@@]1(c2ccc3ccccc3c2)CCCO1.
What is the InChIKey of (2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane?
The InChIKey is BQQDUNKUMFNFLX-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H15F3O/c17-16(18,19)11-15(8-3-9-20-15)14-7-6-12-4-1-2-5-13(12)10-14/h1-2,4-7,10H,3,8-9,11H2/t15-/m1/s1.
What are the key properties of (2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane?
(2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane has a molecular weight of 280.29 g/mol, XLogP of 4.80, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-naphthalen-2-yl-2-(2,2,2-trifluoroethyl)oxolane is sourced from PubChem (CID 166443762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).