2-ethoxy-1,1-difluoropropane

C5H10F2O — CID 10464348

IUPAC2-ethoxy-1,1-difluoropropane
SMILESCCOC(C)C(F)F
InChIInChI=1S/C5H10F2O/c1-3-8-4(2)5(6)7/h4-5H,3H2,1-2H3
InChIKeyRWXICWZMOKHYIH-UHFFFAOYSA-N
MW124.13 g/mol
LogP1.68
Rot. Bonds3

About 2-ethoxy-1,1-difluoropropane

2-ethoxy-1,1-difluoropropane (PubChem CID 10464348) has the molecular formula C5H10F2O and a molecular weight of 124.13 g/mol. Its IUPAC name is 2-ethoxy-1,1-difluoropropane.

Molecular Properties

Compound Name2-ethoxy-1,1-difluoropropane
PubChem CID10464348
Molecular FormulaC5H10F2O
Molecular Weight124.13 g/mol
Exact Mass124.07
IUPAC Name2-ethoxy-1,1-difluoropropane
SMILESCCOC(C)C(F)F
InChIInChI=1S/C5H10F2O/c1-3-8-4(2)5(6)7/h4-5H,3H2,1-2H3
InChIKeyRWXICWZMOKHYIH-UHFFFAOYSA-N
XLogP1.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.13
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1,1-difluoropropane?
The IUPAC name of 2-ethoxy-1,1-difluoropropane (CID 10464348) is 2-ethoxy-1,1-difluoropropane.
What is the SMILES notation for 2-ethoxy-1,1-difluoropropane?
The canonical SMILES for 2-ethoxy-1,1-difluoropropane is CCOC(C)C(F)F.
What is the InChIKey of 2-ethoxy-1,1-difluoropropane?
The InChIKey is RWXICWZMOKHYIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10F2O/c1-3-8-4(2)5(6)7/h4-5H,3H2,1-2H3.
What are the key properties of 2-ethoxy-1,1-difluoropropane?
2-ethoxy-1,1-difluoropropane has a molecular weight of 124.13 g/mol, XLogP of 1.68, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1,1-difluoropropane is sourced from PubChem (CID 10464348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).