2-(fluoromethoxy)hexane

C7H15FO — CID 20614891

IUPAC2-(fluoromethoxy)hexane
SMILESCCCCC(C)OCF
InChIInChI=1S/C7H15FO/c1-3-4-5-7(2)9-6-8/h7H,3-6H2,1-2H3
InChIKeyNDDLLRXDOCKNRU-UHFFFAOYSA-N
MW134.19 g/mol
LogP2.51
Rot. Bonds5

About 2-(fluoromethoxy)hexane

2-(fluoromethoxy)hexane (PubChem CID 20614891) has the molecular formula C7H15FO and a molecular weight of 134.19 g/mol. Its IUPAC name is 2-(fluoromethoxy)hexane.

Molecular Properties

Compound Name2-(fluoromethoxy)hexane
PubChem CID20614891
Molecular FormulaC7H15FO
Molecular Weight134.19 g/mol
Exact Mass134.11
IUPAC Name2-(fluoromethoxy)hexane
SMILESCCCCC(C)OCF
InChIInChI=1S/C7H15FO/c1-3-4-5-7(2)9-6-8/h7H,3-6H2,1-2H3
InChIKeyNDDLLRXDOCKNRU-UHFFFAOYSA-N
XLogP2.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.19
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethoxy)hexane?
The IUPAC name of 2-(fluoromethoxy)hexane (CID 20614891) is 2-(fluoromethoxy)hexane.
What is the SMILES notation for 2-(fluoromethoxy)hexane?
The canonical SMILES for 2-(fluoromethoxy)hexane is CCCCC(C)OCF.
What is the InChIKey of 2-(fluoromethoxy)hexane?
The InChIKey is NDDLLRXDOCKNRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15FO/c1-3-4-5-7(2)9-6-8/h7H,3-6H2,1-2H3.
What are the key properties of 2-(fluoromethoxy)hexane?
2-(fluoromethoxy)hexane has a molecular weight of 134.19 g/mol, XLogP of 2.51, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethoxy)hexane is sourced from PubChem (CID 20614891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).