1,3-difluoro-2-methoxypropane

C4H8F2O — CID 20798611

IUPAC1,3-difluoro-2-methoxypropane
SMILESCOC(CF)CF
InChIInChI=1S/C4H8F2O/c1-7-4(2-5)3-6/h4H,2-3H2,1H3
InChIKeyPTPANVOOYVGNEX-UHFFFAOYSA-N
MW110.10 g/mol
LogP0.94
Rot. Bonds3

About 1,3-difluoro-2-methoxypropane

1,3-difluoro-2-methoxypropane (PubChem CID 20798611) has the molecular formula C4H8F2O and a molecular weight of 110.10 g/mol. Its IUPAC name is 1,3-difluoro-2-methoxypropane.

Molecular Properties

Compound Name1,3-difluoro-2-methoxypropane
PubChem CID20798611
Molecular FormulaC4H8F2O
Molecular Weight110.10 g/mol
Exact Mass110.05
IUPAC Name1,3-difluoro-2-methoxypropane
SMILESCOC(CF)CF
InChIInChI=1S/C4H8F2O/c1-7-4(2-5)3-6/h4H,2-3H2,1H3
InChIKeyPTPANVOOYVGNEX-UHFFFAOYSA-N
XLogP0.94
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.10
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,3-difluoro-2-methoxypropane?
The IUPAC name of 1,3-difluoro-2-methoxypropane (CID 20798611) is 1,3-difluoro-2-methoxypropane.
What is the SMILES notation for 1,3-difluoro-2-methoxypropane?
The canonical SMILES for 1,3-difluoro-2-methoxypropane is COC(CF)CF.
What is the InChIKey of 1,3-difluoro-2-methoxypropane?
The InChIKey is PTPANVOOYVGNEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8F2O/c1-7-4(2-5)3-6/h4H,2-3H2,1H3.
What are the key properties of 1,3-difluoro-2-methoxypropane?
1,3-difluoro-2-methoxypropane has a molecular weight of 110.10 g/mol, XLogP of 0.94, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-difluoro-2-methoxypropane is sourced from PubChem (CID 20798611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).