1-fluoro-4-(methoxymethyl)cyclohexane

C8H15FO — CID 59009677

IUPAC1-fluoro-4-(methoxymethyl)cyclohexane
SMILESCOCC1CCC(F)CC1
InChIInChI=1S/C8H15FO/c1-10-6-7-2-4-8(9)5-3-7/h7-8H,2-6H2,1H3
InChIKeyOKJZMCONFPPBNC-UHFFFAOYSA-N
MW146.20 g/mol
LogP2.16
Rot. Bonds2

About 1-fluoro-4-(methoxymethyl)cyclohexane

1-fluoro-4-(methoxymethyl)cyclohexane (PubChem CID 59009677) has the molecular formula C8H15FO and a molecular weight of 146.20 g/mol. Its IUPAC name is 1-fluoro-4-(methoxymethyl)cyclohexane.

Molecular Properties

Compound Name1-fluoro-4-(methoxymethyl)cyclohexane
PubChem CID59009677
Molecular FormulaC8H15FO
Molecular Weight146.20 g/mol
Exact Mass146.11
IUPAC Name1-fluoro-4-(methoxymethyl)cyclohexane
SMILESCOCC1CCC(F)CC1
InChIInChI=1S/C8H15FO/c1-10-6-7-2-4-8(9)5-3-7/h7-8H,2-6H2,1H3
InChIKeyOKJZMCONFPPBNC-UHFFFAOYSA-N
XLogP2.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.20
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-(methoxymethyl)cyclohexane?
The IUPAC name of 1-fluoro-4-(methoxymethyl)cyclohexane (CID 59009677) is 1-fluoro-4-(methoxymethyl)cyclohexane.
What is the SMILES notation for 1-fluoro-4-(methoxymethyl)cyclohexane?
The canonical SMILES for 1-fluoro-4-(methoxymethyl)cyclohexane is COCC1CCC(F)CC1.
What is the InChIKey of 1-fluoro-4-(methoxymethyl)cyclohexane?
The InChIKey is OKJZMCONFPPBNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15FO/c1-10-6-7-2-4-8(9)5-3-7/h7-8H,2-6H2,1H3.
What are the key properties of 1-fluoro-4-(methoxymethyl)cyclohexane?
1-fluoro-4-(methoxymethyl)cyclohexane has a molecular weight of 146.20 g/mol, XLogP of 2.16, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-(methoxymethyl)cyclohexane is sourced from PubChem (CID 59009677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).