4,4-difluoro-5,6-dimethyl-2,3-dihydropyran

C7H10F2O — CID 67968795

IUPAC4,4-difluoro-5,6-dimethyl-2,3-dihydropyran
SMILESCC1=C(C)C(F)(F)CCO1
InChIInChI=1S/C7H10F2O/c1-5-6(2)10-4-3-7(5,8)9/h3-4H2,1-2H3
InChIKeyYVNBGHDLMWPLOY-UHFFFAOYSA-N
MW148.15 g/mol
LogP2.34
Rot. Bonds

About 4,4-difluoro-5,6-dimethyl-2,3-dihydropyran

4,4-difluoro-5,6-dimethyl-2,3-dihydropyran (PubChem CID 67968795) has the molecular formula C7H10F2O and a molecular weight of 148.15 g/mol. Its IUPAC name is 4,4-difluoro-5,6-dimethyl-2,3-dihydropyran.

Molecular Properties

Compound Name4,4-difluoro-5,6-dimethyl-2,3-dihydropyran
PubChem CID67968795
Molecular FormulaC7H10F2O
Molecular Weight148.15 g/mol
Exact Mass148.07
IUPAC Name4,4-difluoro-5,6-dimethyl-2,3-dihydropyran
SMILESCC1=C(C)C(F)(F)CCO1
InChIInChI=1S/C7H10F2O/c1-5-6(2)10-4-3-7(5,8)9/h3-4H2,1-2H3
InChIKeyYVNBGHDLMWPLOY-UHFFFAOYSA-N
XLogP2.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.15
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4,4-difluoro-5,6-dimethyl-2,3-dihydropyran?
The IUPAC name of 4,4-difluoro-5,6-dimethyl-2,3-dihydropyran (CID 67968795) is 4,4-difluoro-5,6-dimethyl-2,3-dihydropyran.
What is the SMILES notation for 4,4-difluoro-5,6-dimethyl-2,3-dihydropyran?
The canonical SMILES for 4,4-difluoro-5,6-dimethyl-2,3-dihydropyran is CC1=C(C)C(F)(F)CCO1.
What is the InChIKey of 4,4-difluoro-5,6-dimethyl-2,3-dihydropyran?
The InChIKey is YVNBGHDLMWPLOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10F2O/c1-5-6(2)10-4-3-7(5,8)9/h3-4H2,1-2H3.
What are the key properties of 4,4-difluoro-5,6-dimethyl-2,3-dihydropyran?
4,4-difluoro-5,6-dimethyl-2,3-dihydropyran has a molecular weight of 148.15 g/mol, XLogP of 2.34, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-difluoro-5,6-dimethyl-2,3-dihydropyran is sourced from PubChem (CID 67968795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).