2,3-ditert-butyl-1,1-difluorocyclopropane

C11H20F2 — CID 59783656

IUPAC2,3-ditert-butyl-1,1-difluorocyclopropane
SMILESCC(C)(C)C1C(C(C)(C)C)C1(F)F
InChIInChI=1S/C11H20F2/c1-9(2,3)7-8(10(4,5)6)11(7,12)13/h7-8H,1-6H3
InChIKeyRQLMBFIADUOQCT-UHFFFAOYSA-N
MW190.28 g/mol
LogP3.96
Rot. Bonds

About 2,3-ditert-butyl-1,1-difluorocyclopropane

2,3-ditert-butyl-1,1-difluorocyclopropane (PubChem CID 59783656) has the molecular formula C11H20F2 and a molecular weight of 190.28 g/mol. Its IUPAC name is 2,3-ditert-butyl-1,1-difluorocyclopropane.

Molecular Properties

Compound Name2,3-ditert-butyl-1,1-difluorocyclopropane
PubChem CID59783656
Molecular FormulaC11H20F2
Molecular Weight190.28 g/mol
Exact Mass190.15
IUPAC Name2,3-ditert-butyl-1,1-difluorocyclopropane
SMILESCC(C)(C)C1C(C(C)(C)C)C1(F)F
InChIInChI=1S/C11H20F2/c1-9(2,3)7-8(10(4,5)6)11(7,12)13/h7-8H,1-6H3
InChIKeyRQLMBFIADUOQCT-UHFFFAOYSA-N
XLogP3.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.28
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,3-ditert-butyl-1,1-difluorocyclopropane?
The IUPAC name of 2,3-ditert-butyl-1,1-difluorocyclopropane (CID 59783656) is 2,3-ditert-butyl-1,1-difluorocyclopropane.
What is the SMILES notation for 2,3-ditert-butyl-1,1-difluorocyclopropane?
The canonical SMILES for 2,3-ditert-butyl-1,1-difluorocyclopropane is CC(C)(C)C1C(C(C)(C)C)C1(F)F.
What is the InChIKey of 2,3-ditert-butyl-1,1-difluorocyclopropane?
The InChIKey is RQLMBFIADUOQCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F2/c1-9(2,3)7-8(10(4,5)6)11(7,12)13/h7-8H,1-6H3.
What are the key properties of 2,3-ditert-butyl-1,1-difluorocyclopropane?
2,3-ditert-butyl-1,1-difluorocyclopropane has a molecular weight of 190.28 g/mol, XLogP of 3.96, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-ditert-butyl-1,1-difluorocyclopropane is sourced from PubChem (CID 59783656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).