fluoromethane;oxane

C6H13FO — CID 171551127

IUPACfluoromethane;oxane
SMILESC1CCOCC1.CF
InChIInChI=1S/C5H10O.CH3F/c1-2-4-6-5-3-1;1-2/h1-5H2;1H3
InChIKeyDKHFXWKBQCZJNO-UHFFFAOYSA-N
MW120.17 g/mol
LogP1.77
Rot. Bonds

About fluoromethane;oxane

fluoromethane;oxane (PubChem CID 171551127) has the molecular formula C6H13FO and a molecular weight of 120.17 g/mol. Its IUPAC name is fluoromethane;oxane.

Molecular Properties

Compound Namefluoromethane;oxane
PubChem CID171551127
Molecular FormulaC6H13FO
Molecular Weight120.17 g/mol
Exact Mass120.10
IUPAC Namefluoromethane;oxane
SMILESC1CCOCC1.CF
InChIInChI=1S/C5H10O.CH3F/c1-2-4-6-5-3-1;1-2/h1-5H2;1H3
InChIKeyDKHFXWKBQCZJNO-UHFFFAOYSA-N
XLogP1.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.17
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of fluoromethane;oxane?
The IUPAC name of fluoromethane;oxane (CID 171551127) is fluoromethane;oxane.
What is the SMILES notation for fluoromethane;oxane?
The canonical SMILES for fluoromethane;oxane is C1CCOCC1.CF.
What is the InChIKey of fluoromethane;oxane?
The InChIKey is DKHFXWKBQCZJNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10O.CH3F/c1-2-4-6-5-3-1;1-2/h1-5H2;1H3.
What are the key properties of fluoromethane;oxane?
fluoromethane;oxane has a molecular weight of 120.17 g/mol, XLogP of 1.77, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for fluoromethane;oxane is sourced from PubChem (CID 171551127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).