3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane

C7H11F3O2 — CID 22247113

IUPAC3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane
SMILESCC1(COC(F)C(F)F)COC1
InChIInChI=1S/C7H11F3O2/c1-7(2-11-3-7)4-12-6(10)5(8)9/h5-6H,2-4H2,1H3
InChIKeyVDJHQMSKDQCYGJ-UHFFFAOYSA-N
MW184.16 g/mol
LogP1.60
Rot. Bonds4

About 3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane

3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane (PubChem CID 22247113) has the molecular formula C7H11F3O2 and a molecular weight of 184.16 g/mol. Its IUPAC name is 3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane.

Molecular Properties

Compound Name3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane
PubChem CID22247113
Molecular FormulaC7H11F3O2
Molecular Weight184.16 g/mol
Exact Mass184.07
IUPAC Name3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane
SMILESCC1(COC(F)C(F)F)COC1
InChIInChI=1S/C7H11F3O2/c1-7(2-11-3-7)4-12-6(10)5(8)9/h5-6H,2-4H2,1H3
InChIKeyVDJHQMSKDQCYGJ-UHFFFAOYSA-N
XLogP1.60
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.16
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Oxetane, 3-methyl-3-[(2,2,2-trifluoroethoxy)methyl]-
CID 15457423
Oxetane, 3-methyl-3-[(2,2,3,3,3-pentafluoropropoxy)methyl]-
CID 57507141
3-[(2,2,3,3,4,4,4-Heptafluorobutoxy)methyl]-3-methyloxetane
CID 22015266
3-(Difluor-aminomethyl)-3-methyloxetane
CID 129735476
3-(1,1,2,3,3,3-Hexafluoropropoxymethyl)-3-methyloxetane
CID 11172786
Oxetane, 3,3-bis[(2,2,2-trifluoroethoxy)methyl]-
CID 11818371
3-Methyl-3-(1,1,2,3,3,4,4,4-octafluorobutoxymethyl)oxetane
CID 12010403
3,3-Dimethyloxetane;2,2,3-trifluorooxirane
CID 18471375
3,3-Bis(1,1,2,2,3,4,4-heptafluorobutoxymethyl)oxetane
CID 19043787
3,3-Bis[difluoro(1,1,1,2,3-pentafluoropropan-2-yloxy)methyl]oxetane
CID 20372924
3-Methyl-3-(1,1,2-trifluoroethoxymethyl)oxetane
CID 22015273
3-(2,2,3,3,4,4,4-Heptafluorobutoxymethyl)-3-(2,2,2-trifluoroethoxymethyl)oxetane
CID 22247105

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane?
The IUPAC name of 3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane (CID 22247113) is 3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane.
What is the SMILES notation for 3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane?
The canonical SMILES for 3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane is CC1(COC(F)C(F)F)COC1.
What is the InChIKey of 3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane?
The InChIKey is VDJHQMSKDQCYGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3O2/c1-7(2-11-3-7)4-12-6(10)5(8)9/h5-6H,2-4H2,1H3.
What are the key properties of 3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane?
3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane has a molecular weight of 184.16 g/mol, XLogP of 1.60, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-(1,2,2-trifluoroethoxymethyl)oxetane is sourced from PubChem (CID 22247113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).