1-(fluoromethoxy)cyclohexene

C7H11FO — CID 21447465

IUPAC1-(fluoromethoxy)cyclohexene
SMILESFCOC1=CCCCC1
InChIInChI=1S/C7H11FO/c8-6-9-7-4-2-1-3-5-7/h4H,1-3,5-6H2
InChIKeyQAVLWZMQVCXQRE-UHFFFAOYSA-N
MW130.16 g/mol
LogP2.39
Rot. Bonds2

About 1-(fluoromethoxy)cyclohexene

1-(fluoromethoxy)cyclohexene (PubChem CID 21447465) has the molecular formula C7H11FO and a molecular weight of 130.16 g/mol. Its IUPAC name is 1-(fluoromethoxy)cyclohexene.

Molecular Properties

Compound Name1-(fluoromethoxy)cyclohexene
PubChem CID21447465
Molecular FormulaC7H11FO
Molecular Weight130.16 g/mol
Exact Mass130.08
IUPAC Name1-(fluoromethoxy)cyclohexene
SMILESFCOC1=CCCCC1
InChIInChI=1S/C7H11FO/c8-6-9-7-4-2-1-3-5-7/h4H,1-3,5-6H2
InChIKeyQAVLWZMQVCXQRE-UHFFFAOYSA-N
XLogP2.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.16
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(fluoromethoxy)cyclohexene?
The IUPAC name of 1-(fluoromethoxy)cyclohexene (CID 21447465) is 1-(fluoromethoxy)cyclohexene.
What is the SMILES notation for 1-(fluoromethoxy)cyclohexene?
The canonical SMILES for 1-(fluoromethoxy)cyclohexene is FCOC1=CCCCC1.
What is the InChIKey of 1-(fluoromethoxy)cyclohexene?
The InChIKey is QAVLWZMQVCXQRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11FO/c8-6-9-7-4-2-1-3-5-7/h4H,1-3,5-6H2.
What are the key properties of 1-(fluoromethoxy)cyclohexene?
1-(fluoromethoxy)cyclohexene has a molecular weight of 130.16 g/mol, XLogP of 2.39, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(fluoromethoxy)cyclohexene is sourced from PubChem (CID 21447465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).