1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane

C8H15F — CID 121273952

IUPAC1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane
SMILESCCC1(C)C(F)C1(C)C
InChIInChI=1S/C8H15F/c1-5-8(4)6(9)7(8,2)3/h6H,5H2,1-4H3
InChIKeyDHEXAEQJIKGHFZ-UHFFFAOYSA-N
MW130.21 g/mol
LogP2.78
Rot. Bonds1

About 1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane

1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane (PubChem CID 121273952) has the molecular formula C8H15F and a molecular weight of 130.21 g/mol. Its IUPAC name is 1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane.

Molecular Properties

Compound Name1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane
PubChem CID121273952
Molecular FormulaC8H15F
Molecular Weight130.21 g/mol
Exact Mass130.12
IUPAC Name1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane
SMILESCCC1(C)C(F)C1(C)C
InChIInChI=1S/C8H15F/c1-5-8(4)6(9)7(8,2)3/h6H,5H2,1-4H3
InChIKeyDHEXAEQJIKGHFZ-UHFFFAOYSA-N
XLogP2.78
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.21
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-ethyl-1,2,4,4-tetramethylbicyclo[1.1.0]butane
CID 123284470
3-tert-butyl-1-ethyl-1,2,2-trimethylcyclopropane
CID 123195790
1-ethyl-1,2,3-trimethyl-2-propan-2-ylcyclopropane
CID 91546237
4-ethyl-3,4,5,5-tetramethyl-3H-pyrazole
CID 134536778
1,3-diethyl-1-methyl-2,2-di(propan-2-yl)cyclopropane
CID 123596430
1,1,2,3-tetramethyl-2-propylcyclopropane
CID 90999525
(1-ethyl-3-fluorocyclobutyl)hydrazine
CID 166983927
(2R,4R)-2,3,4-triethyl-2,3,4,5-tetramethyloxolane
CID 58591824
7-ethyl-1,2,7-trimethylbicyclo[2.2.1]heptane
CID 142049190
1,1-diethyl-2,2-difluoro-3,3-dimethylcyclopropane
CID 121274118
1-ethyl-2-hexan-3-yl-1,2,3-trimethylcyclopropane
CID 123787972
2,2,3-trimethyl-3-(2,2,2-trifluoroethyl)cyclopropane-1-carboxylic acid
CID 57304145

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane?
The IUPAC name of 1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane (CID 121273952) is 1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane.
What is the SMILES notation for 1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane?
The canonical SMILES for 1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane is CCC1(C)C(F)C1(C)C.
What is the InChIKey of 1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane?
The InChIKey is DHEXAEQJIKGHFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15F/c1-5-8(4)6(9)7(8,2)3/h6H,5H2,1-4H3.
What are the key properties of 1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane?
1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane has a molecular weight of 130.21 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 1-ethyl-3-fluoro-1,2,2-trimethylcyclopropane is sourced from PubChem (CID 121273952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).