2,3,3-trimethyl-2-(trifluoromethyl)oxetane

C7H11F3O — CID 151927741

IUPAC2,3,3-trimethyl-2-(trifluoromethyl)oxetane
SMILESCC1(C)COC1(C)C(F)(F)F
InChIInChI=1S/C7H11F3O/c1-5(2)4-11-6(5,3)7(8,9)10/h4H2,1-3H3
InChIKeySYDGBVQMAZVQNP-UHFFFAOYSA-N
MW168.16 g/mol
LogP2.36
Rot. Bonds

About 2,3,3-trimethyl-2-(trifluoromethyl)oxetane

2,3,3-trimethyl-2-(trifluoromethyl)oxetane (PubChem CID 151927741) has the molecular formula C7H11F3O and a molecular weight of 168.16 g/mol. Its IUPAC name is 2,3,3-trimethyl-2-(trifluoromethyl)oxetane.

Molecular Properties

Compound Name2,3,3-trimethyl-2-(trifluoromethyl)oxetane
PubChem CID151927741
Molecular FormulaC7H11F3O
Molecular Weight168.16 g/mol
Exact Mass168.08
IUPAC Name2,3,3-trimethyl-2-(trifluoromethyl)oxetane
SMILESCC1(C)COC1(C)C(F)(F)F
InChIInChI=1S/C7H11F3O/c1-5(2)4-11-6(5,3)7(8,9)10/h4H2,1-3H3
InChIKeySYDGBVQMAZVQNP-UHFFFAOYSA-N
XLogP2.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.16
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3,3-Difluoro-2,2-dimethyloxetane
CID 162535828
3,3,4-Trifluoro-2,2-dimethyloxetane
CID 13526672
3-Tert-butyl-3-(trifluoromethyl)oxetane
CID 116875849
3-Ethyl-3-(trifluoromethyl)oxetane
CID 117550906
3-Propan-2-yl-3-(trifluoromethyl)oxetane
CID 117550907
3-(Difluoromethyl)-3-ethyloxetane
CID 117956425
3-Tert-butyl-2,2-difluorooxetane
CID 126763945
3-Tert-butyl-2,3-difluorooxetane
CID 126763947
3-(1,1-Difluoroethyl)-3-methyloxetane
CID 138553538
2-Methyl-2-(trifluoromethyl)oxetane
CID 158413150
3-Methyl-3-(2,2,2-trifluoroethyl)oxetane
CID 160542076
3-(Difluoromethyl)-3-propan-2-yloxetane
CID 166573211

Frequently Asked Questions

What is the IUPAC name of 2,3,3-trimethyl-2-(trifluoromethyl)oxetane?
The IUPAC name of 2,3,3-trimethyl-2-(trifluoromethyl)oxetane (CID 151927741) is 2,3,3-trimethyl-2-(trifluoromethyl)oxetane.
What is the SMILES notation for 2,3,3-trimethyl-2-(trifluoromethyl)oxetane?
The canonical SMILES for 2,3,3-trimethyl-2-(trifluoromethyl)oxetane is CC1(C)COC1(C)C(F)(F)F.
What is the InChIKey of 2,3,3-trimethyl-2-(trifluoromethyl)oxetane?
The InChIKey is SYDGBVQMAZVQNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3O/c1-5(2)4-11-6(5,3)7(8,9)10/h4H2,1-3H3.
What are the key properties of 2,3,3-trimethyl-2-(trifluoromethyl)oxetane?
2,3,3-trimethyl-2-(trifluoromethyl)oxetane has a molecular weight of 168.16 g/mol, XLogP of 2.36, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3-trimethyl-2-(trifluoromethyl)oxetane is sourced from PubChem (CID 151927741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).