3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane

C10H17FO2 — CID 139336531

IUPAC3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane
SMILESCC1CC(F)(COC2CCOC2)C1
InChIInChI=1S/C10H17FO2/c1-8-4-10(11,5-8)7-13-9-2-3-12-6-9/h8-9H,2-7H2,1H3
InChIKeyXQKBRRSEJQYXMP-UHFFFAOYSA-N
MW188.24 g/mol
LogP1.93
Rot. Bonds3

About 3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane

3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane (PubChem CID 139336531) has the molecular formula C10H17FO2 and a molecular weight of 188.24 g/mol. Its IUPAC name is 3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane.

Molecular Properties

Compound Name3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane
PubChem CID139336531
Molecular FormulaC10H17FO2
Molecular Weight188.24 g/mol
Exact Mass188.12
IUPAC Name3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane
SMILESCC1CC(F)(COC2CCOC2)C1
InChIInChI=1S/C10H17FO2/c1-8-4-10(11,5-8)7-13-9-2-3-12-6-9/h8-9H,2-7H2,1H3
InChIKeyXQKBRRSEJQYXMP-UHFFFAOYSA-N
XLogP1.93
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.24
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-Fluoro-1-propan-2-yloxypropan-2-yl)oxy-2-methylpentane
CID 167285904
CID 173646226
CID 173646226
CID 173646228
CID 173646228
3-Methyl-4-pentoxyoxolane
CID 167227502
CID 161362597
CID 161362597
CID 161362598
CID 161362598
(3S)-3-(2-methylpentan-3-yloxy)oxolane
CID 178417250
2,4-Dimethyl-3-propoxyoxolane
CID 68223994
(4R)-2,4-dimethyl-3-propoxyoxolane
CID 89231419
(4S)-2,4-dimethyl-3-propoxyoxolane
CID 89258066
(4S)-3-ethoxy-2,4-dimethyloxolane
CID 89332944
CID 126735450
CID 126735450

Frequently Asked Questions

What is the IUPAC name of 3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane?
The IUPAC name of 3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane (CID 139336531) is 3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane.
What is the SMILES notation for 3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane?
The canonical SMILES for 3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane is CC1CC(F)(COC2CCOC2)C1.
What is the InChIKey of 3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane?
The InChIKey is XQKBRRSEJQYXMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17FO2/c1-8-4-10(11,5-8)7-13-9-2-3-12-6-9/h8-9H,2-7H2,1H3.
What are the key properties of 3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane?
3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane has a molecular weight of 188.24 g/mol, XLogP of 1.93, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-fluoro-3-methylcyclobutyl)methoxy]oxolane is sourced from PubChem (CID 139336531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).