(2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane

C11H20F2O — CID 130279038

IUPAC(2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane
SMILESCCCC(C)[C@@]1(C)CCC(F)(F)CO1
InChIInChI=1S/C11H20F2O/c1-4-5-9(2)10(3)6-7-11(12,13)8-14-10/h9H,4-8H2,1-3H3/t9?,10-/m1/s1
InChIKeyXGALNONSTIWPIA-QVDQXJPCSA-N
MW206.28 g/mol
LogP3.63
Rot. Bonds3

About (2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane

(2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane (PubChem CID 130279038) has the molecular formula C11H20F2O and a molecular weight of 206.28 g/mol. Its IUPAC name is (2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane.

Molecular Properties

Compound Name(2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane
PubChem CID130279038
Molecular FormulaC11H20F2O
Molecular Weight206.28 g/mol
Exact Mass206.15
IUPAC Name(2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane
SMILESCCCC(C)[C@@]1(C)CCC(F)(F)CO1
InChIInChI=1S/C11H20F2O/c1-4-5-9(2)10(3)6-7-11(12,13)8-14-10/h9H,4-8H2,1-3H3/t9?,10-/m1/s1
InChIKeyXGALNONSTIWPIA-QVDQXJPCSA-N
XLogP3.63
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 57090603
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Frequently Asked Questions

What is the IUPAC name of (2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane?
The IUPAC name of (2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane (CID 130279038) is (2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane.
What is the SMILES notation for (2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane?
The canonical SMILES for (2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane is CCCC(C)[C@@]1(C)CCC(F)(F)CO1.
What is the InChIKey of (2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane?
The InChIKey is XGALNONSTIWPIA-QVDQXJPCSA-N. The full InChI is InChI=1S/C11H20F2O/c1-4-5-9(2)10(3)6-7-11(12,13)8-14-10/h9H,4-8H2,1-3H3/t9?,10-/m1/s1.
What are the key properties of (2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane?
(2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane has a molecular weight of 206.28 g/mol, XLogP of 3.63, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-5,5-difluoro-2-methyl-2-pentan-2-yloxane is sourced from PubChem (CID 130279038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).