1,1,1,3-tetrafluoro-3-methoxypentane

C6H10F4O — CID 57324047

IUPAC1,1,1,3-tetrafluoro-3-methoxypentane
SMILESCCC(F)(CC(F)(F)F)OC
InChIInChI=1S/C6H10F4O/c1-3-5(7,11-2)4-6(8,9)10/h3-4H2,1-2H3
InChIKeyIISKGCSZKOUHQW-UHFFFAOYSA-N
MW174.14 g/mol
LogP2.66
Rot. Bonds3

About 1,1,1,3-tetrafluoro-3-methoxypentane

1,1,1,3-tetrafluoro-3-methoxypentane (PubChem CID 57324047) has the molecular formula C6H10F4O and a molecular weight of 174.14 g/mol. Its IUPAC name is 1,1,1,3-tetrafluoro-3-methoxypentane.

Molecular Properties

Compound Name1,1,1,3-tetrafluoro-3-methoxypentane
PubChem CID57324047
Molecular FormulaC6H10F4O
Molecular Weight174.14 g/mol
Exact Mass174.07
IUPAC Name1,1,1,3-tetrafluoro-3-methoxypentane
SMILESCCC(F)(CC(F)(F)F)OC
InChIInChI=1S/C6H10F4O/c1-3-5(7,11-2)4-6(8,9)10/h3-4H2,1-2H3
InChIKeyIISKGCSZKOUHQW-UHFFFAOYSA-N
XLogP2.66
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.14
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1,1,3-tetrafluoro-3-methoxypentane?
The IUPAC name of 1,1,1,3-tetrafluoro-3-methoxypentane (CID 57324047) is 1,1,1,3-tetrafluoro-3-methoxypentane.
What is the SMILES notation for 1,1,1,3-tetrafluoro-3-methoxypentane?
The canonical SMILES for 1,1,1,3-tetrafluoro-3-methoxypentane is CCC(F)(CC(F)(F)F)OC.
What is the InChIKey of 1,1,1,3-tetrafluoro-3-methoxypentane?
The InChIKey is IISKGCSZKOUHQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10F4O/c1-3-5(7,11-2)4-6(8,9)10/h3-4H2,1-2H3.
What are the key properties of 1,1,1,3-tetrafluoro-3-methoxypentane?
1,1,1,3-tetrafluoro-3-methoxypentane has a molecular weight of 174.14 g/mol, XLogP of 2.66, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,3-tetrafluoro-3-methoxypentane is sourced from PubChem (CID 57324047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).