1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane

C7H11F3O — CID 139399697

IUPAC1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane
SMILESCCOCC1(C(F)(F)F)CC1
InChIInChI=1S/C7H11F3O/c1-2-11-5-6(3-4-6)7(8,9)10/h2-5H2,1H3
InChIKeyFSGRXBWZZZPSPJ-UHFFFAOYSA-N
MW168.16 g/mol
LogP2.37
Rot. Bonds3

About 1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane

1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane (PubChem CID 139399697) has the molecular formula C7H11F3O and a molecular weight of 168.16 g/mol. Its IUPAC name is 1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane.

Molecular Properties

Compound Name1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane
PubChem CID139399697
Molecular FormulaC7H11F3O
Molecular Weight168.16 g/mol
Exact Mass168.08
IUPAC Name1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane
SMILESCCOCC1(C(F)(F)F)CC1
InChIInChI=1S/C7H11F3O/c1-2-11-5-6(3-4-6)7(8,9)10/h2-5H2,1H3
InChIKeyFSGRXBWZZZPSPJ-UHFFFAOYSA-N
XLogP2.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.16
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane?
The IUPAC name of 1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane (CID 139399697) is 1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane.
What is the SMILES notation for 1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane?
The canonical SMILES for 1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane is CCOCC1(C(F)(F)F)CC1.
What is the InChIKey of 1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane?
The InChIKey is FSGRXBWZZZPSPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3O/c1-2-11-5-6(3-4-6)7(8,9)10/h2-5H2,1H3.
What are the key properties of 1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane?
1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane has a molecular weight of 168.16 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethoxymethyl)-1-(trifluoromethyl)cyclopropane is sourced from PubChem (CID 139399697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).