(2,6-difluorophenyl)-(oxolan-2-yl)methanone

C11H10F2O2 — CID 65331301

IUPAC(2,6-difluorophenyl)-(oxolan-2-yl)methanone
SMILESO=C(c1c(F)cccc1F)C1CCCO1
InChIInChI=1S/C11H10F2O2/c12-7-3-1-4-8(13)10(7)11(14)9-5-2-6-15-9/h1,3-4,9H,2,5-6H2
InChIKeyVUQPIUZEXHQGLY-UHFFFAOYSA-N
MW212.19 g/mol
LogP2.33
Rot. Bonds2

About (2,6-difluorophenyl)-(oxolan-2-yl)methanone

(2,6-difluorophenyl)-(oxolan-2-yl)methanone (PubChem CID 65331301) has the molecular formula C11H10F2O2 and a molecular weight of 212.19 g/mol. Its IUPAC name is (2,6-difluorophenyl)-(oxolan-2-yl)methanone.

Molecular Properties

Compound Name(2,6-difluorophenyl)-(oxolan-2-yl)methanone
PubChem CID65331301
Molecular FormulaC11H10F2O2
Molecular Weight212.19 g/mol
Exact Mass212.06
IUPAC Name(2,6-difluorophenyl)-(oxolan-2-yl)methanone
SMILESO=C(c1c(F)cccc1F)C1CCCO1
InChIInChI=1S/C11H10F2O2/c12-7-3-1-4-8(13)10(7)11(14)9-5-2-6-15-9/h1,3-4,9H,2,5-6H2
InChIKeyVUQPIUZEXHQGLY-UHFFFAOYSA-N
XLogP2.33
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.19
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2,6-difluorophenyl)-(oxolan-2-yl)methanone?
The IUPAC name of (2,6-difluorophenyl)-(oxolan-2-yl)methanone (CID 65331301) is (2,6-difluorophenyl)-(oxolan-2-yl)methanone.
What is the SMILES notation for (2,6-difluorophenyl)-(oxolan-2-yl)methanone?
The canonical SMILES for (2,6-difluorophenyl)-(oxolan-2-yl)methanone is O=C(c1c(F)cccc1F)C1CCCO1.
What is the InChIKey of (2,6-difluorophenyl)-(oxolan-2-yl)methanone?
The InChIKey is VUQPIUZEXHQGLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F2O2/c12-7-3-1-4-8(13)10(7)11(14)9-5-2-6-15-9/h1,3-4,9H,2,5-6H2.
What are the key properties of (2,6-difluorophenyl)-(oxolan-2-yl)methanone?
(2,6-difluorophenyl)-(oxolan-2-yl)methanone has a molecular weight of 212.19 g/mol, XLogP of 2.33, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-difluorophenyl)-(oxolan-2-yl)methanone is sourced from PubChem (CID 65331301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).