ethane;2-methyl-3-(trifluoromethyl)oxolane

C8H15F3O — CID 170752702

IUPACethane;2-methyl-3-(trifluoromethyl)oxolane
SMILESCC.CC1OCCC1C(F)(F)F
InChIInChI=1S/C6H9F3O.C2H6/c1-4-5(2-3-10-4)6(7,8)9;1-2/h4-5H,2-3H2,1H3;1-2H3
InChIKeyYFOKALLFFNNPPL-UHFFFAOYSA-N
MW184.20 g/mol
LogP3.00
Rot. Bonds

About ethane;2-methyl-3-(trifluoromethyl)oxolane

ethane;2-methyl-3-(trifluoromethyl)oxolane (PubChem CID 170752702) has the molecular formula C8H15F3O and a molecular weight of 184.20 g/mol. Its IUPAC name is ethane;2-methyl-3-(trifluoromethyl)oxolane.

Molecular Properties

Compound Nameethane;2-methyl-3-(trifluoromethyl)oxolane
PubChem CID170752702
Molecular FormulaC8H15F3O
Molecular Weight184.20 g/mol
Exact Mass184.11
IUPAC Nameethane;2-methyl-3-(trifluoromethyl)oxolane
SMILESCC.CC1OCCC1C(F)(F)F
InChIInChI=1S/C6H9F3O.C2H6/c1-4-5(2-3-10-4)6(7,8)9;1-2/h4-5H,2-3H2,1H3;1-2H3
InChIKeyYFOKALLFFNNPPL-UHFFFAOYSA-N
XLogP3.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.20
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze ethane;2-methyl-3-(trifluoromethyl)oxolane 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

3-tert-butyl-2-methyloxolane;methane
CID 158649776
(3R)-2-methyloxolan-3-ol
CID 89032581
(3R)-2,3-dimethyl-1,4-dioxane
CID 134576356
2-methyloxolan-3-ol;silicic acid
CID 70548601
3-(difluoromethyl)-2-methyloxolane
CID 171762048
1-methyl-2-(trifluoromethyl)cyclopropane
CID 19768867
(2R,3S)-3-chloro-2-methyloxolane
CID 13296748
N-[2-fluoro-4-(trifluoromethyl)phenyl]-2-methyloxolan-3-amine
CID 103873048
1-methyl-2-(trifluoromethyl)cyclohexane
CID 18711399
1-methoxy-2-(trifluoromethyl)cyclohexane;hydrofluoride
CID 158258914
2-methyloxolane-3-sulfonyl fluoride
CID 165460627
2-methyl-N-[2-(trifluoromethylsulfanyl)ethyl]oxolan-3-amine
CID 115751228

Frequently Asked Questions

What is the IUPAC name of ethane;2-methyl-3-(trifluoromethyl)oxolane?
The IUPAC name of ethane;2-methyl-3-(trifluoromethyl)oxolane (CID 170752702) is ethane;2-methyl-3-(trifluoromethyl)oxolane.
What is the SMILES notation for ethane;2-methyl-3-(trifluoromethyl)oxolane?
The canonical SMILES for ethane;2-methyl-3-(trifluoromethyl)oxolane is CC.CC1OCCC1C(F)(F)F.
What is the InChIKey of ethane;2-methyl-3-(trifluoromethyl)oxolane?
The InChIKey is YFOKALLFFNNPPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F3O.C2H6/c1-4-5(2-3-10-4)6(7,8)9;1-2/h4-5H,2-3H2,1H3;1-2H3.
What are the key properties of ethane;2-methyl-3-(trifluoromethyl)oxolane?
ethane;2-methyl-3-(trifluoromethyl)oxolane has a molecular weight of 184.20 g/mol, XLogP of 3.00, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methyl-3-(trifluoromethyl)oxolane is sourced from PubChem (CID 170752702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).