ethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane

C8H15F3O — CID 144773876

IUPACethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane
SMILESCC.COCC1(C(F)(F)F)CC1
InChIInChI=1S/C6H9F3O.C2H6/c1-10-4-5(2-3-5)6(7,8)9;1-2/h2-4H2,1H3;1-2H3
InChIKeyGXGTUWAJRRDDOE-UHFFFAOYSA-N
MW184.20 g/mol
LogP3.00
Rot. Bonds2

About ethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane

ethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane (PubChem CID 144773876) has the molecular formula C8H15F3O and a molecular weight of 184.20 g/mol. Its IUPAC name is ethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane.

Molecular Properties

Compound Nameethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane
PubChem CID144773876
Molecular FormulaC8H15F3O
Molecular Weight184.20 g/mol
Exact Mass184.11
IUPAC Nameethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane
SMILESCC.COCC1(C(F)(F)F)CC1
InChIInChI=1S/C6H9F3O.C2H6/c1-10-4-5(2-3-5)6(7,8)9;1-2/h2-4H2,1H3;1-2H3
InChIKeyGXGTUWAJRRDDOE-UHFFFAOYSA-N
XLogP3.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
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

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Frequently Asked Questions

What is the IUPAC name of ethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane?
The IUPAC name of ethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane (CID 144773876) is ethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane.
What is the SMILES notation for ethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane?
The canonical SMILES for ethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane is CC.COCC1(C(F)(F)F)CC1.
What is the InChIKey of ethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane?
The InChIKey is GXGTUWAJRRDDOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9F3O.C2H6/c1-10-4-5(2-3-5)6(7,8)9;1-2/h2-4H2,1H3;1-2H3.
What are the key properties of ethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane?
ethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane has a molecular weight of 184.20 g/mol, XLogP of 3.00, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(methoxymethyl)-1-(trifluoromethyl)cyclopropane is sourced from PubChem (CID 144773876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).