2-(fluoromethyl)-3,4-dihydro-2H-pyran

C6H9FO — CID 152651060

IUPAC2-(fluoromethyl)-3,4-dihydro-2H-pyran
SMILESFCC1CCC=CO1
InChIInChI=1S/C6H9FO/c7-5-6-3-1-2-4-8-6/h2,4,6H,1,3,5H2
InChIKeyZHOHHUKTXAASLV-UHFFFAOYSA-N
MW116.13 g/mol
LogP1.65
Rot. Bonds1

About 2-(fluoromethyl)-3,4-dihydro-2H-pyran

2-(fluoromethyl)-3,4-dihydro-2H-pyran (PubChem CID 152651060) has the molecular formula C6H9FO and a molecular weight of 116.13 g/mol. Its IUPAC name is 2-(fluoromethyl)-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name2-(fluoromethyl)-3,4-dihydro-2H-pyran
PubChem CID152651060
Molecular FormulaC6H9FO
Molecular Weight116.13 g/mol
Exact Mass116.06
IUPAC Name2-(fluoromethyl)-3,4-dihydro-2H-pyran
SMILESFCC1CCC=CO1
InChIInChI=1S/C6H9FO/c7-5-6-3-1-2-4-8-6/h2,4,6H,1,3,5H2
InChIKeyZHOHHUKTXAASLV-UHFFFAOYSA-N
XLogP1.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.13
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(fluoromethyl)-3,4-dihydro-2H-pyran?
The IUPAC name of 2-(fluoromethyl)-3,4-dihydro-2H-pyran (CID 152651060) is 2-(fluoromethyl)-3,4-dihydro-2H-pyran.
What is the SMILES notation for 2-(fluoromethyl)-3,4-dihydro-2H-pyran?
The canonical SMILES for 2-(fluoromethyl)-3,4-dihydro-2H-pyran is FCC1CCC=CO1.
What is the InChIKey of 2-(fluoromethyl)-3,4-dihydro-2H-pyran?
The InChIKey is ZHOHHUKTXAASLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FO/c7-5-6-3-1-2-4-8-6/h2,4,6H,1,3,5H2.
What are the key properties of 2-(fluoromethyl)-3,4-dihydro-2H-pyran?
2-(fluoromethyl)-3,4-dihydro-2H-pyran has a molecular weight of 116.13 g/mol, XLogP of 1.65, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoromethyl)-3,4-dihydro-2H-pyran is sourced from PubChem (CID 152651060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).