2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol

C10H17F3O2 — CID 82959192

IUPAC2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol
SMILESCCC1(C)C(O)CC1OCCC(F)(F)F
InChIInChI=1S/C10H17F3O2/c1-3-9(2)7(14)6-8(9)15-5-4-10(11,12)13/h7-8,14H,3-6H2,1-2H3
InChIKeyXYHYGOVOQHVSLG-UHFFFAOYSA-N
MW226.24 g/mol
LogP2.50
Rot. Bonds4

About 2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol

2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol (PubChem CID 82959192) has the molecular formula C10H17F3O2 and a molecular weight of 226.24 g/mol. Its IUPAC name is 2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol.

Molecular Properties

Compound Name2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol
PubChem CID82959192
Molecular FormulaC10H17F3O2
Molecular Weight226.24 g/mol
Exact Mass226.12
IUPAC Name2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol
SMILESCCC1(C)C(O)CC1OCCC(F)(F)F
InChIInChI=1S/C10H17F3O2/c1-3-9(2)7(14)6-8(9)15-5-4-10(11,12)13/h7-8,14H,3-6H2,1-2H3
InChIKeyXYHYGOVOQHVSLG-UHFFFAOYSA-N
XLogP2.50
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-amine
CID 82957725
3-(2-ethoxyethoxy)-2-ethyl-2-methylcyclobutan-1-ol
CID 66367098
3-(3,3-dimethylbutoxy)-2-ethyl-2-methylcyclobutan-1-amine
CID 66353159
3-(cycloheptylmethoxy)-2-ethyl-2-methylcyclobutan-1-ol
CID 114249116
2,2-diethyl-3-(2,2,2-trifluoroethoxy)cyclobutan-1-ol
CID 66366275
2-propoxy-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol
CID 107942629
3-(3,3-dimethylbutoxy)-N,2-diethyl-2-methylcyclobutan-1-amine
CID 66351618
2-ethyl-2-methyl-3-(4-methylcyclohexyl)oxycyclobutan-1-ol
CID 66368538
2-ethyl-2-methyl-3-(thiophen-2-ylmethoxy)cyclobutan-1-ol
CID 66343326
2-ethyl-2-methyl-3-(2,3,5,6-tetrafluorophenoxy)cyclobutan-1-ol
CID 103290555
2-ethyl-3-(3-fluoro-4-methylphenoxy)-2-methylcyclobutan-1-ol
CID 107171617
2-ethyl-2-methyl-3-(4-propylphenoxy)cyclobutan-1-ol
CID 66343544

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol?
The IUPAC name of 2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol (CID 82959192) is 2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol.
What is the SMILES notation for 2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol?
The canonical SMILES for 2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol is CCC1(C)C(O)CC1OCCC(F)(F)F.
What is the InChIKey of 2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol?
The InChIKey is XYHYGOVOQHVSLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3O2/c1-3-9(2)7(14)6-8(9)15-5-4-10(11,12)13/h7-8,14H,3-6H2,1-2H3.
What are the key properties of 2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol?
2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol has a molecular weight of 226.24 g/mol, XLogP of 2.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-methyl-3-(3,3,3-trifluoropropoxy)cyclobutan-1-ol is sourced from PubChem (CID 82959192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).