2-ethyl-1,1,2-trifluoro-3-methylcyclobutane

C7H11F3 — CID 162585247

IUPAC2-ethyl-1,1,2-trifluoro-3-methylcyclobutane
SMILESCCC1(F)C(C)CC1(F)F
InChIInChI=1S/C7H11F3/c1-3-6(8)5(2)4-7(6,9)10/h5H,3-4H2,1-2H3
InChIKeyLIHWYANRSOJOTP-UHFFFAOYSA-N
MW152.16 g/mol
LogP2.78
Rot. Bonds1

About 2-ethyl-1,1,2-trifluoro-3-methylcyclobutane

2-ethyl-1,1,2-trifluoro-3-methylcyclobutane (PubChem CID 162585247) has the molecular formula C7H11F3 and a molecular weight of 152.16 g/mol. Its IUPAC name is 2-ethyl-1,1,2-trifluoro-3-methylcyclobutane.

Molecular Properties

Compound Name2-ethyl-1,1,2-trifluoro-3-methylcyclobutane
PubChem CID162585247
Molecular FormulaC7H11F3
Molecular Weight152.16 g/mol
Exact Mass152.08
IUPAC Name2-ethyl-1,1,2-trifluoro-3-methylcyclobutane
SMILESCCC1(F)C(C)CC1(F)F
InChIInChI=1S/C7H11F3/c1-3-6(8)5(2)4-7(6,9)10/h5H,3-4H2,1-2H3
InChIKeyLIHWYANRSOJOTP-UHFFFAOYSA-N
XLogP2.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.16
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(2R)-1-fluoro-1,2-dimethylcyclopropane
CID 147738297
(1R)-1-ethyl-1,2-dimethylcyclopropane
CID 177128711
(2R)-2-ethyl-1,1-difluorocyclopropane
CID 123881327
1-ethyl-1,2-dimethylcyclopropane
CID 524629
1-ethyl-3-(1-ethyl-2-methylcyclopropyl)bicyclo[2.1.0]pentane
CID 123146097
1-cyclopropyl-1-ethyl-2-methylcyclopropane
CID 22389706
1-ethyltricyclo[2.2.1.02,6]heptane
CID 12951260
2,5-diethyl-1,1-difluorocyclopentane
CID 20771103
1-cycloprop-2-en-1-yl-1-ethyl-2-methylcyclopropane
CID 123542377
1-ethyl-2,5-dimethyl-1-propylcyclopentane
CID 145269100
1,1-diethyl-3-methylcyclobutane;methane
CID 171820543
1,1-diethyl-3,5-dimethylcyclohexane
CID 91010762

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1,1,2-trifluoro-3-methylcyclobutane?
The IUPAC name of 2-ethyl-1,1,2-trifluoro-3-methylcyclobutane (CID 162585247) is 2-ethyl-1,1,2-trifluoro-3-methylcyclobutane.
What is the SMILES notation for 2-ethyl-1,1,2-trifluoro-3-methylcyclobutane?
The canonical SMILES for 2-ethyl-1,1,2-trifluoro-3-methylcyclobutane is CCC1(F)C(C)CC1(F)F.
What is the InChIKey of 2-ethyl-1,1,2-trifluoro-3-methylcyclobutane?
The InChIKey is LIHWYANRSOJOTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3/c1-3-6(8)5(2)4-7(6,9)10/h5H,3-4H2,1-2H3.
What are the key properties of 2-ethyl-1,1,2-trifluoro-3-methylcyclobutane?
2-ethyl-1,1,2-trifluoro-3-methylcyclobutane has a molecular weight of 152.16 g/mol, XLogP of 2.78, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1,1,2-trifluoro-3-methylcyclobutane is sourced from PubChem (CID 162585247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).