6,6-difluoro-2,3-dihydropyran

C5H6F2O — CID 22709101

IUPAC6,6-difluoro-2,3-dihydropyran
SMILESFC1(F)C=CCCO1
InChIInChI=1S/C5H6F2O/c6-5(7)3-1-2-4-8-5/h1,3H,2,4H2
InChIKeyQVEUPNNLWBKOGN-UHFFFAOYSA-N
MW120.10 g/mol
LogP1.56
Rot. Bonds

About 6,6-difluoro-2,3-dihydropyran

6,6-difluoro-2,3-dihydropyran (PubChem CID 22709101) has the molecular formula C5H6F2O and a molecular weight of 120.10 g/mol. Its IUPAC name is 6,6-difluoro-2,3-dihydropyran.

Molecular Properties

Compound Name6,6-difluoro-2,3-dihydropyran
PubChem CID22709101
Molecular FormulaC5H6F2O
Molecular Weight120.10 g/mol
Exact Mass120.04
IUPAC Name6,6-difluoro-2,3-dihydropyran
SMILESFC1(F)C=CCCO1
InChIInChI=1S/C5H6F2O/c6-5(7)3-1-2-4-8-5/h1,3H,2,4H2
InChIKeyQVEUPNNLWBKOGN-UHFFFAOYSA-N
XLogP1.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.10
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3,6-Dihydro-2H-pyran
CID 520540
2-(Trifluoromethyl)-3,6-dihydro-2H-pyran
CID 57069777
(5R)-5-(trifluoromethoxy)cyclohexa-1,3-diene
CID 155788491
2-(Trifluoromethyl)-2,5-dihydrofuran
CID 21810352
5-(Trifluoromethoxy)cyclohexa-1,3-diene
CID 18457037
4,4,5,5-Tetrafluoro-1-(4,4,5,5-tetrafluoropent-2-enoxy)pent-2-ene
CID 89405455
(6S)-3,3-difluoro-6-methyl-2,6-dihydropyran
CID 91078551
1-Fluoro-6-(trifluoromethoxy)cyclohexa-1,4-diene
CID 91147737
2-fluoro-3,6-dihydro-2H-pyran
CID 121273713
(Z)-5,5,5-trifluoro-1-methoxypent-2-ene
CID 141961907
5-fluoro-3,6-dihydro-2H-pyran
CID 144199000
2,2,6,6-tetrafluoro-3H-pyran
CID 149825461

Frequently Asked Questions

What is the IUPAC name of 6,6-difluoro-2,3-dihydropyran?
The IUPAC name of 6,6-difluoro-2,3-dihydropyran (CID 22709101) is 6,6-difluoro-2,3-dihydropyran.
What is the SMILES notation for 6,6-difluoro-2,3-dihydropyran?
The canonical SMILES for 6,6-difluoro-2,3-dihydropyran is FC1(F)C=CCCO1.
What is the InChIKey of 6,6-difluoro-2,3-dihydropyran?
The InChIKey is QVEUPNNLWBKOGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6F2O/c6-5(7)3-1-2-4-8-5/h1,3H,2,4H2.
What are the key properties of 6,6-difluoro-2,3-dihydropyran?
6,6-difluoro-2,3-dihydropyran has a molecular weight of 120.10 g/mol, XLogP of 1.56, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-difluoro-2,3-dihydropyran is sourced from PubChem (CID 22709101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).