1,3-diethyl-2,2-difluoro-1-methylcyclopropane

C8H14F2 — CID 18684549

IUPAC1,3-diethyl-2,2-difluoro-1-methylcyclopropane
SMILESCCC1C(F)(F)C1(C)CC
InChIInChI=1S/C8H14F2/c1-4-6-7(3,5-2)8(6,9)10/h6H,4-5H2,1-3H3
InChIKeyCXKGFMGPEORSNC-UHFFFAOYSA-N
MW148.20 g/mol
LogP3.08
Rot. Bonds2

About 1,3-diethyl-2,2-difluoro-1-methylcyclopropane

1,3-diethyl-2,2-difluoro-1-methylcyclopropane (PubChem CID 18684549) has the molecular formula C8H14F2 and a molecular weight of 148.20 g/mol. Its IUPAC name is 1,3-diethyl-2,2-difluoro-1-methylcyclopropane.

Molecular Properties

Compound Name1,3-diethyl-2,2-difluoro-1-methylcyclopropane
PubChem CID18684549
Molecular FormulaC8H14F2
Molecular Weight148.20 g/mol
Exact Mass148.11
IUPAC Name1,3-diethyl-2,2-difluoro-1-methylcyclopropane
SMILESCCC1C(F)(F)C1(C)CC
InChIInChI=1S/C8H14F2/c1-4-6-7(3,5-2)8(6,9)10/h6H,4-5H2,1-3H3
InChIKeyCXKGFMGPEORSNC-UHFFFAOYSA-N
XLogP3.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

3-Butyl-1,1-difluoro-2,2-dimethylcyclopropane
CID 132918858
2-(Difluoromethyl)-1,1-dimethylcyclopropane
CID 132092316
1,1-Difluoro-2,2,3-trimethyl-cyclopropane
CID 569328
1-Propyl-1-(trifluoromethyl)cyclopropane
CID 68096317
2,3-Dimethyl-1,1-bis(trifluoromethyl)cyclopropane
CID 74023411
3-Ethyl-1,1-difluoro-2,2-dimethylcyclopropane
CID 121273882
1,1-Difluoro-2-methyl-3-propylcyclopropane
CID 15062437
1-Ethyl-2,2-difluoro-1,3-dimethylcyclopropane
CID 18684620
1,1,1,2,2,3,3,4,4-Nonafluoro-5,6,6-trimethylheptane
CID 18711328
2,2,5,5-Tetramethyl-3-(trifluoromethyl)hexane
CID 20625080
2,3-Diethyl-1,1-difluorocyclopropane
CID 24974569
1,1,1-Trifluoro-2,2,3-tris(trifluoromethyl)hexane
CID 54178514

Frequently Asked Questions

What is the IUPAC name of 1,3-diethyl-2,2-difluoro-1-methylcyclopropane?
The IUPAC name of 1,3-diethyl-2,2-difluoro-1-methylcyclopropane (CID 18684549) is 1,3-diethyl-2,2-difluoro-1-methylcyclopropane.
What is the SMILES notation for 1,3-diethyl-2,2-difluoro-1-methylcyclopropane?
The canonical SMILES for 1,3-diethyl-2,2-difluoro-1-methylcyclopropane is CCC1C(F)(F)C1(C)CC.
What is the InChIKey of 1,3-diethyl-2,2-difluoro-1-methylcyclopropane?
The InChIKey is CXKGFMGPEORSNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2/c1-4-6-7(3,5-2)8(6,9)10/h6H,4-5H2,1-3H3.
What are the key properties of 1,3-diethyl-2,2-difluoro-1-methylcyclopropane?
1,3-diethyl-2,2-difluoro-1-methylcyclopropane has a molecular weight of 148.20 g/mol, XLogP of 3.08, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diethyl-2,2-difluoro-1-methylcyclopropane is sourced from PubChem (CID 18684549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).