(2S,5S)-2,5-bis(fluoromethyl)oxolane

C6H10F2O — CID 118183548

IUPAC(2S,5S)-2,5-bis(fluoromethyl)oxolane
SMILESFC[C@@H]1CC[C@@H](CF)O1
InChIInChI=1S/C6H10F2O/c7-3-5-1-2-6(4-8)9-5/h5-6H,1-4H2/t5-,6-/m0/s1
InChIKeyYVYHMNXSRQSFGP-WDSKDSINSA-N
MW136.14 g/mol
LogP1.47
Rot. Bonds2

About (2S,5S)-2,5-bis(fluoromethyl)oxolane

(2S,5S)-2,5-bis(fluoromethyl)oxolane (PubChem CID 118183548) has the molecular formula C6H10F2O and a molecular weight of 136.14 g/mol. Its IUPAC name is (2S,5S)-2,5-bis(fluoromethyl)oxolane.

Molecular Properties

Compound Name(2S,5S)-2,5-bis(fluoromethyl)oxolane
PubChem CID118183548
Molecular FormulaC6H10F2O
Molecular Weight136.14 g/mol
Exact Mass136.07
IUPAC Name(2S,5S)-2,5-bis(fluoromethyl)oxolane
SMILESFC[C@@H]1CC[C@@H](CF)O1
InChIInChI=1S/C6H10F2O/c7-3-5-1-2-6(4-8)9-5/h5-6H,1-4H2/t5-,6-/m0/s1
InChIKeyYVYHMNXSRQSFGP-WDSKDSINSA-N
XLogP1.47
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.14
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2S,5S)-2,5-bis(fluoromethyl)oxolane?
The IUPAC name of (2S,5S)-2,5-bis(fluoromethyl)oxolane (CID 118183548) is (2S,5S)-2,5-bis(fluoromethyl)oxolane.
What is the SMILES notation for (2S,5S)-2,5-bis(fluoromethyl)oxolane?
The canonical SMILES for (2S,5S)-2,5-bis(fluoromethyl)oxolane is FC[C@@H]1CC[C@@H](CF)O1.
What is the InChIKey of (2S,5S)-2,5-bis(fluoromethyl)oxolane?
The InChIKey is YVYHMNXSRQSFGP-WDSKDSINSA-N. The full InChI is InChI=1S/C6H10F2O/c7-3-5-1-2-6(4-8)9-5/h5-6H,1-4H2/t5-,6-/m0/s1.
What are the key properties of (2S,5S)-2,5-bis(fluoromethyl)oxolane?
(2S,5S)-2,5-bis(fluoromethyl)oxolane has a molecular weight of 136.14 g/mol, XLogP of 1.47, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,5S)-2,5-bis(fluoromethyl)oxolane is sourced from PubChem (CID 118183548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).