2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran

C7H10F2O — CID 176929414

IUPAC2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran
SMILESCC1=CC(C(C)(F)F)OC1
InChIInChI=1S/C7H10F2O/c1-5-3-6(10-4-5)7(2,8)9/h3,6H,4H2,1-2H3
InChIKeyVSEIOUWFGNEAES-UHFFFAOYSA-N
MW148.15 g/mol
LogP1.99
Rot. Bonds1

About 2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran

2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran (PubChem CID 176929414) has the molecular formula C7H10F2O and a molecular weight of 148.15 g/mol. Its IUPAC name is 2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran.

Molecular Properties

Compound Name2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran
PubChem CID176929414
Molecular FormulaC7H10F2O
Molecular Weight148.15 g/mol
Exact Mass148.07
IUPAC Name2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran
SMILESCC1=CC(C(C)(F)F)OC1
InChIInChI=1S/C7H10F2O/c1-5-3-6(10-4-5)7(2,8)9/h3,6H,4H2,1-2H3
InChIKeyVSEIOUWFGNEAES-UHFFFAOYSA-N
XLogP1.99
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.15
LogP ≤ 51.99
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

2-(Trifluoromethyl)-2,5-dihydrofuran
CID 21810352
(2R)-2-[(E)-but-2-en-2-yl]-3-methyl-2,5-dihydrofuran
CID 10219468
2,3-Dimethyl-2,5-dihydrofuran
CID 11093674
(2S)-2-[(E)-but-2-en-2-yl]-3-methyl-2,5-dihydrofuran
CID 11309546
2-(But-2-en-2-yl)-3-methyl-2,5-dihydrofuran
CID 11446369
(2R)-3-methyl-2-prop-1-en-2-yl-2,5-dihydrofuran
CID 15361420
3-Methyl-2-prop-1-en-2-yl-2,5-dihydrofuran
CID 22948196
(2S)-2-[(Z)-but-2-en-2-yl]-3-methyl-2,5-dihydrofuran
CID 59047503
2-But-2-en-2-yl-3-methyl-2,5-dihydrofuran
CID 71360342
2,5-difluoro-3,5-bis(trifluoromethyl)-2H-furan
CID 23236321
(1E)-1-ethylidene-2-(2,2,2-trifluoroethoxy)cyclopentane
CID 131863587
2-Methyl-3-(trifluoromethyl)-7-oxabicyclo[2.2.1]hepta-2,5-diene
CID 20679312

Frequently Asked Questions

What is the IUPAC name of 2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran?
The IUPAC name of 2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran (CID 176929414) is 2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran.
What is the SMILES notation for 2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran?
The canonical SMILES for 2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran is CC1=CC(C(C)(F)F)OC1.
What is the InChIKey of 2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran?
The InChIKey is VSEIOUWFGNEAES-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F2O/c1-5-3-6(10-4-5)7(2,8)9/h3,6H,4H2,1-2H3.
What are the key properties of 2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran?
2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran has a molecular weight of 148.15 g/mol, XLogP of 1.99, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1-difluoroethyl)-4-methyl-2,5-dihydrofuran is sourced from PubChem (CID 176929414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).