1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane

C8H14F2 — CID 89275697

IUPAC1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane
SMILESCCC1(C(C)C)CC1(F)F
InChIInChI=1S/C8H14F2/c1-4-7(6(2)3)5-8(7,9)10/h6H,4-5H2,1-3H3
InChIKeyLIBFDPHNIBNMRN-UHFFFAOYSA-N
MW148.20 g/mol
LogP3.08
Rot. Bonds2

About 1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane

1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane (PubChem CID 89275697) has the molecular formula C8H14F2 and a molecular weight of 148.20 g/mol. Its IUPAC name is 1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane.

Molecular Properties

Compound Name1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane
PubChem CID89275697
Molecular FormulaC8H14F2
Molecular Weight148.20 g/mol
Exact Mass148.11
IUPAC Name1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane
SMILESCCC1(C(C)C)CC1(F)F
InChIInChI=1S/C8H14F2/c1-4-7(6(2)3)5-8(7,9)10/h6H,4-5H2,1-3H3
InChIKeyLIBFDPHNIBNMRN-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-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane?
The IUPAC name of 1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane (CID 89275697) is 1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane.
What is the SMILES notation for 1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane?
The canonical SMILES for 1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane is CCC1(C(C)C)CC1(F)F.
What is the InChIKey of 1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane?
The InChIKey is LIBFDPHNIBNMRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2/c1-4-7(6(2)3)5-8(7,9)10/h6H,4-5H2,1-3H3.
What are the key properties of 1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane?
1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane 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-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane is sourced from PubChem (CID 89275697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).