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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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).