2,6-bis(trifluoromethyl)-2H-pyran

C7H4F6O — CID 22022752

IUPAC2,6-bis(trifluoromethyl)-2H-pyran
SMILESFC(F)(F)C1=CC=CC(C(F)(F)F)O1
InChIInChI=1S/C7H4F6O/c8-6(9,10)4-2-1-3-5(14-4)7(11,12)13/h1-4H
InChIKeyAJKILDSUGRMPBB-UHFFFAOYSA-N
MW218.10 g/mol
LogP2.95
Rot. Bonds

About 2,6-bis(trifluoromethyl)-2H-pyran

2,6-bis(trifluoromethyl)-2H-pyran (PubChem CID 22022752) has the molecular formula C7H4F6O and a molecular weight of 218.10 g/mol. Its IUPAC name is 2,6-bis(trifluoromethyl)-2H-pyran.

Molecular Properties

Compound Name2,6-bis(trifluoromethyl)-2H-pyran
PubChem CID22022752
Molecular FormulaC7H4F6O
Molecular Weight218.10 g/mol
Exact Mass218.02
IUPAC Name2,6-bis(trifluoromethyl)-2H-pyran
SMILESFC(F)(F)C1=CC=CC(C(F)(F)F)O1
InChIInChI=1S/C7H4F6O/c8-6(9,10)4-2-1-3-5(14-4)7(11,12)13/h1-4H
InChIKeyAJKILDSUGRMPBB-UHFFFAOYSA-N
XLogP2.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.10
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(5R)-5-(trifluoromethoxy)cyclohexa-1,3-diene
CID 155788491
2-(Difluoromethoxy)cyclohexa-1,3-diene
CID 18363256
2-(1,1,2,2-Tetrafluoroethoxy)cyclohexa-1,3-diene
CID 18427019
5-(Trifluoromethoxy)cyclohexa-1,3-diene
CID 18457037
2-(Trifluoromethoxy)cyclohexa-1,3-diene
CID 18614397
6-(1,1,2,2,3,3,3-heptafluoropropyl)-2H-pyran
CID 20427195
6-Fluoro-2-(1,1,2,2-tetrafluoroethoxy)cyclohexa-1,3-diene
CID 58898152
5-methylidene-2-(trifluoromethyl)-2H-furan
CID 68253835
3,5-bis(difluoromethyl)-2H-pyran
CID 68794114
2-(1,1,2,2,3,3,3-heptafluoropropyl)-2H-pyran
CID 87197835
1-Fluoro-6-(trifluoromethoxy)cyclohexa-1,4-diene
CID 91147737
3-(2,2,2-Trifluoroethoxy)hepta-2,4-diene
CID 91263829

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(trifluoromethyl)-2H-pyran?
The IUPAC name of 2,6-bis(trifluoromethyl)-2H-pyran (CID 22022752) is 2,6-bis(trifluoromethyl)-2H-pyran.
What is the SMILES notation for 2,6-bis(trifluoromethyl)-2H-pyran?
The canonical SMILES for 2,6-bis(trifluoromethyl)-2H-pyran is FC(F)(F)C1=CC=CC(C(F)(F)F)O1.
What is the InChIKey of 2,6-bis(trifluoromethyl)-2H-pyran?
The InChIKey is AJKILDSUGRMPBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F6O/c8-6(9,10)4-2-1-3-5(14-4)7(11,12)13/h1-4H.
What are the key properties of 2,6-bis(trifluoromethyl)-2H-pyran?
2,6-bis(trifluoromethyl)-2H-pyran has a molecular weight of 218.10 g/mol, XLogP of 2.95, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(trifluoromethyl)-2H-pyran is sourced from PubChem (CID 22022752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).